N-[(2S)-1-[(4-acetamidophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[(4-acetamidophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[(4-acetamidophenyl)carbamoyl]-3-methylsulfanyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-(4-acetamidoanilino)-4-(methylthio)-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-(4-acetamidoanilino)-4-methylsulfanyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[(4-acetamidophenyl)carbamoyl]-3-(methylthio)propyl]-2-furamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H21N3O4S/c1-12(22)19-13-5-7-14(8-6-13)20-17(23)15(9-11-26-2)21-18(24)16-4-3-10-25-16/h3-8,10,15H,9,11H2,1-2H3,(H,19,22)(H,20,23)(H,21,24)/t15-/m0/s1