2-[(1-methylindol-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(1-methylindol-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(1-methylindole-3-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(1-methyl-3-indolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(1-methylindole-3-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(1-methylindole-3-carbonyl)amino]-4-(methylthio)butyric acid Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C15H18N2O3S/c1-17-9-11(10-5-3-4-6-13(10)17)14(18)16-12(15(19)20)7-8-21-2/h3-6,9,12H,7-8H2,1-2H3,(H,16,18)(H,19,20)