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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C3CCCCC3=C(N=C2S1)CC4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C3CCCCC3=C(N=C2S1)CC4=CC=CC=C4)N

InChI

InChI=1S/C21H22N2O2S/c1-2-25-21(24)19-18(22)17-15-11-7-6-10-14(15)16(23-20(17)26-19)12-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12,22H2,1H3