(2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(5-methoxy-1-methyl-indol-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(5-methoxy-1-methyl-2-indolyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(5-methoxy-1-methyl-indole-2-carbonyl)amino]-4-(methylthio)butyrate Formula: C16H19N2O4S- MolecularWeight: 335.39806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C16H20N2O4S/c1-18-13-5-4-11(22-2)8-10(13)9-14(18)15(19)17-12(16(20)21)6-7-23-3/h4-5,8-9,12H,6-7H2,1-3H3,(H,17,19)(H,20,21)/p-1/t12-/m0/s1