IUPAC Name: 4-[[1-(4-butylphenyl)-4-chloro-2,5-dioxopyrrol-3-yl]amino]

[Synonyms]

[Structure]

[ Properties Computed from Structure]

Molecular Weight	509.0197 [g/mol]
Molecular Formula	C26H25ClN4O3S
XLogP	5.5
H-Bond Donor	2
H-Bond Acceptor	5
Rotatable Bond Count	8
Tautomer Count	14
Exact Mass	508.133589
MonoIsotopic Mass	508.133589
Topological Polar Surface Area	91.4
Heavy Atom Count	35
Formal Charge	0
Complexity	837
Isotope Atom Count	0
Defined Atom StereoCenter Count	0
Undefined Atom StereoCenter Count	0
Defined Bond StereoCenter Count	0
Undefined Bond StereoCenter Count	0
Covalently-Bonded Unit Count	1

[ Descriptors Computed from Structure]
IUPAC Name: 4-[[1-(4-butylphenyl)-4-chloro-2,5-dioxopyrrol-3-yl]amino]-N-(4,
5-dimethyl-1,3-thiazol-2-yl)benzamide
Canonical SMILES: CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)C(=O)NC4=NC(=C(S4)C)C
InChI: InChI=1/C26H25ClN4O3S/c1-4-5-6-17-7-13-20(14-8-17)31-24(33)21(27)22(25
(31)34)29-19-11-9-18(10-12-19)23(32)30-26-28-15(2)16(3)35-26/h7-14,29H,
4-6H2,1-3H3,(H,28,30,32)/f/h30H