(2-methylphenyl) 1-azanyl-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate

Systemtic Name: (2-methylphenyl) 1-azanyl-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Openeye Name: o-tolyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate CAS Name: 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Traditional Name: 1-amino-5-ethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxylic acid o-tolyl ester Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)OC4=CC=CC=C4C)N

Isomeric SMILES

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)OC4=CC=CC=C4C)N

InChI

InChI=1S/C21H22N2O2S/c1-3-15-13-9-5-6-10-14(13)17-18(22)19(26-20(17)23-15)21(24)25-16-11-7-4-8-12(16)2/h4,7-8,11H,3,5-6,9-10,22H2,1-2H3