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

Systemtic Name: 1-azanyl-5-ethyl-N-(phenylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-benzyl-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-5-ethyl-N-(phenylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-benzyl-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-benzyl-5-ethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NCC4=CC=CC=C4)N

Isomeric SMILES

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NCC4=CC=CC=C4)N

InChI

InChI=1S/C21H23N3OS/c1-2-16-14-10-6-7-11-15(14)17-18(22)19(26-21(17)24-16)20(25)23-12-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12,22H2,1H3,(H,23,25)