methyl 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CN2CCC3=CC=CC=C3C2

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CN2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H18N2O3S/c1-22-17(21)14-7-9-23-16(14)18-15(20)11-19-8-6-12-4-2-3-5-13(12)10-19/h2-5,7,9H,6,8,10-11H2,1H3,(H,18,20)