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

Systemtic Name: propan-2-yl 1-azanyl-5-(thiophen-2-ylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Openeye Name: isopropyl 1-amino-5-(2-thienylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate CAS Name: 1-amino-5-(thiophen-2-ylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-amino-5-(thiophen-2-ylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Traditional Name: 1-amino-5-(2-thenyl)-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxylic acid isopropyl ester Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C2=C3CCCCC3=C(N=C2S1)CC4=CC=CS4)N

Isomeric SMILES

CC(C)OC(=O)C1=C(C2=C3CCCCC3=C(N=C2S1)CC4=CC=CS4)N

InChI

InChI=1S/C20H22N2O2S2/c1-11(2)24-20(23)18-17(21)16-14-8-4-3-7-13(14)15(22-19(16)26-18)10-12-6-5-9-25-12/h5-6,9,11H,3-4,7-8,10,21H2,1-2H3