(2S)-2-acetamido-N-(4-methyl-2-oxidanylidene-chromen-7-yl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-(4-methyl-2-oxidanylidene-chromen-7-yl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-acetamido-N-(4-methyl-2-oxo-chromen-7-yl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-acetamido-N-(4-methyl-2-oxo-1-benzopyran-7-yl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-acetamido-N-(4-methyl-2-oxochromen-7-yl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-acetamido-N-(2-keto-4-methyl-chromen-7-yl)-4-(methylthio)butyramide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCSC)NC(=O)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCSC)NC(=O)C

InChI

InChI=1S/C17H20N2O4S/c1-10-8-16(21)23-15-9-12(4-5-13(10)15)19-17(22)14(6-7-24-3)18-11(2)20/h4-5,8-9,14H,6-7H2,1-3H3,(H,18,20)(H,19,22)/t14-/m0/s1