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

Systemtic Name: 1-azanyl-N-(5-chloranyl-2-methoxy-phenyl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-(5-chloro-2-methoxy-phenyl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-N-(5-chloro-2-methoxyphenyl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-(5-chloro-2-methoxyphenyl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-(5-chloro-2-methoxy-phenyl)-5-ethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NC4=C(C=CC(=C4)Cl)OC)N

Isomeric SMILES

CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NC4=C(C=CC(=C4)Cl)OC)N

InChI

InChI=1S/C21H22ClN3O2S/c1-3-14-12-6-4-5-7-13(12)17-18(23)19(28-21(17)25-14)20(26)24-15-10-11(22)8-9-16(15)27-2/h8-10H,3-7,23H2,1-2H3,(H,24,26)