methyl 6-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]hexanoate CAS Name: 6-[[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]hexanoate Traditional Name: 6-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]hexanoic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=C(C=CS1)N2C=CC=C2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=C(C=CS1)N2C=CC=C2

InChI

InChI=1S/C16H20N2O3S/c1-21-14(19)7-3-2-4-9-17-16(20)15-13(8-12-22-15)18-10-5-6-11-18/h5-6,8,10-12H,2-4,7,9H2,1H3,(H,17,20)