ethyl 2-azanyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-amino-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-amino-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCC3=CC=CC=C3C2)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCC3=CC=CC=C3C2)N

InChI

InChI=1S/C18H20N2O3S/c1-3-23-18(22)14-11(2)15(24-16(14)19)17(21)20-9-8-12-6-4-5-7-13(12)10-20/h4-7H,3,8-10,19H2,1-2H3