4-(4-methylphenyl)-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]thiophene-3-carboxamide

Systemtic Name: 4-(4-methylphenyl)-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]thiophene-3-carboxamide Openeye Name: 4-(p-tolyl)-2-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanoylamino]thiophene-3-carboxamide CAS Name: 4-(4-methylphenyl)-2-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-(4-methylphenyl)-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]thiophene-3-carboxamide Traditional Name: 4-(p-tolyl)-2-[2-[(4,6,8-trimethyl-2-quinolyl)thio]butanoylamino]thiophene-3-carboxamide Formula: C28H29N3O2S2 MolecularWeight: 503.67876

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)N)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)N)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C

InChI

InChI=1S/C28H29N3O2S2/c1-6-22(35-23-13-17(4)20-12-16(3)11-18(5)25(20)30-23)27(33)31-28-24(26(29)32)21(14-34-28)19-9-7-15(2)8-10-19/h7-14,22H,6H2,1-5H3,(H2,29,32)(H,31,33)