propan-2-yl 4-methylsulfanyl-2-[(2-pyrrol-1-ylphenyl)carbonylamino]butanoate

Systemtic Name: propan-2-yl 4-methylsulfanyl-2-[(2-pyrrol-1-ylphenyl)carbonylamino]butanoate Openeye Name: isopropyl 4-methylsulfanyl-2-[(2-pyrrol-1-ylbenzoyl)amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]amino]butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methylsulfanyl-2-[(2-pyrrol-1-ylbenzoyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(2-pyrrol-1-ylbenzoyl)amino]butyric acid isopropyl ester Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=O)C1=CC=CC=C1N2C=CC=C2

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=O)C1=CC=CC=C1N2C=CC=C2

InChI

InChI=1S/C19H24N2O3S/c1-14(2)24-19(23)16(10-13-25-3)20-18(22)15-8-4-5-9-17(15)21-11-6-7-12-21/h4-9,11-12,14,16H,10,13H2,1-3H3,(H,20,22)