N-[4-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-carbamoyl]phenyl]thiophene-2-carboxamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H21N3O3S2/c1-25(14-20(26)24-17-6-3-4-7-18(17)29-2)22(28)15-9-11-16(12-10-15)23-21(27)19-8-5-13-30-19/h3-13H,14H2,1-2H3,(H,23,27)(H,24,26)