4-azanyl-5-(3,4-dichlorophenyl)carbonyl-2-[(4-methoxyphenyl)amino]-N-phenyl-1H-pyrrole-3-carbothioamide

Systemtic Name: 4-azanyl-5-(3,4-dichlorophenyl)carbonyl-2-[(4-methoxyphenyl)amino]-N-phenyl-1H-pyrrole-3-carbothioamide Openeye Name: 4-amino-5-(3,4-dichlorobenzoyl)-2-(4-methoxyanilino)-N-phenyl-1H-pyrrole-3-carbothioamide CAS Name: 4-amino-5-[(3,4-dichlorophenyl)-oxomethyl]-2-(4-methoxyanilino)-N-phenyl-1H-pyrrole-3-carbothioamide IUPAC Name: 4-amino-5-(3,4-dichlorobenzoyl)-2-(4-methoxyanilino)-N-phenyl-1H-pyrrole-3-carbothioamide Traditional Name: 4-amino-5-(3,4-dichlorobenzoyl)-2-(p-anisidino)-N-phenyl-1H-pyrrole-3-carbothioamide Formula: C25H20Cl2N4O2S MolecularWeight: 511.4229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C(=C(N2)C(=O)C3=CC(=C(C=C3)Cl)Cl)N)C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C(=C(N2)C(=O)C3=CC(=C(C=C3)Cl)Cl)N)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H20Cl2N4O2S/c1-33-17-10-8-16(9-11-17)29-24-20(25(34)30-15-5-3-2-4-6-15)21(28)22(31-24)23(32)14-7-12-18(26)19(27)13-14/h2-13,29,31H,28H2,1H3,(H,30,34)