3-azanyl-N4-(4-chlorophenyl)-N2-(2-cyanophenyl)-5-[(4-ethoxyphenyl)amino]thiophene-2,4-dicarboxamide

Systemtic Name: 3-azanyl-N4-(4-chlorophenyl)-N2-(2-cyanophenyl)-5-[(4-ethoxyphenyl)amino]thiophene-2,4-dicarboxamide Openeye Name: 3-amino-N4-(4-chlorophenyl)-N2-(2-cyanophenyl)-5-(4-ethoxyanilino)thiophene-2,4-dicarboxamide CAS Name: 3-amino-N4-(4-chlorophenyl)-N2-(2-cyanophenyl)-5-(4-ethoxyanilino)thiophene-2,4-dicarboxamide IUPAC Name: 3-amino-4-N-(4-chlorophenyl)-2-N-(2-cyanophenyl)-5-(4-ethoxyanilino)thiophene-2,4-dicarboxamide Traditional Name: 3-amino-N'-(4-chlorophenyl)-N-(2-cyanophenyl)-5-(p-phenetidino)thiophene-2,4-dicarboxamide Formula: C27H22ClN5O3S MolecularWeight: 532.01328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC=CC=C3C#N)N)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC=CC=C3C#N)N)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H22ClN5O3S/c1-2-36-20-13-11-19(12-14-20)32-27-22(25(34)31-18-9-7-17(28)8-10-18)23(30)24(37-27)26(35)33-21-6-4-3-5-16(21)15-29/h3-14,32H,2,30H2,1H3,(H,31,34)(H,33,35)