3-azanyl-N2-(3-ethanoylphenyl)-5-[(4-methylphenyl)amino]-N4-(2-morpholin-4-ylethyl)thiophene-2,4-dicarboxamide

Systemtic Name: 3-azanyl-N2-(3-ethanoylphenyl)-5-[(4-methylphenyl)amino]-N4-(2-morpholin-4-ylethyl)thiophene-2,4-dicarboxamide Openeye Name: N2-(3-acetylphenyl)-3-amino-5-(4-methylanilino)-N4-(2-morpholinoethyl)thiophene-2,4-dicarboxamide CAS Name: N2-(3-acetylphenyl)-3-amino-5-(4-methylanilino)-N4-[2-(4-morpholinyl)ethyl]thiophene-2,4-dicarboxamide IUPAC Name: 2-N-(3-acetylphenyl)-3-amino-5-(4-methylanilino)-4-N-(2-morpholin-4-ylethyl)thiophene-2,4-dicarboxamide Traditional Name: N-(3-acetylphenyl)-3-amino-N'-(2-morpholinoethyl)-5-(p-toluidino)thiophene-2,4-dicarboxamide Formula: C27H31N5O4S MolecularWeight: 521.63114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC=CC(=C3)C(=O)C)N)C(=O)NCCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)NC3=CC=CC(=C3)C(=O)C)N)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C27H31N5O4S/c1-17-6-8-20(9-7-17)31-27-22(25(34)29-10-11-32-12-14-36-15-13-32)23(28)24(37-27)26(35)30-21-5-3-4-19(16-21)18(2)33/h3-9,16,31H,10-15,28H2,1-2H3,(H,29,34)(H,30,35)