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

Systemtic Name: (3-methylphenyl) 1-azanyl-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Openeye Name: m-tolyl 1-amino-5-(2-thienyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate CAS Name: 1-amino-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 1-amino-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Traditional Name: 1-amino-5-(2-thienyl)-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxylic acid m-tolyl ester Formula: C23H20N2O2S2 MolecularWeight: 420.5471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)C5=CC=CS5)N

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)C5=CC=CS5)N

InChI

InChI=1S/C23H20N2O2S2/c1-13-6-4-7-14(12-13)27-23(26)21-19(24)18-15-8-2-3-9-16(15)20(25-22(18)29-21)17-10-5-11-28-17/h4-7,10-12H,2-3,8-9,24H2,1H3