1-phenyl-N-[2-(thian-4-yl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclopropane-1-carboxamide

Systemtic Name: 1-phenyl-N-[2-(thian-4-yl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclopropane-1-carboxamide Openeye Name: 1-phenyl-N-(2-tetrahydrothiopyran-4-yl-3,4-dihydro-1H-isoquinolin-7-yl)cyclopropanecarboxamide CAS Name: 1-phenyl-N-[2-(4-thianyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-cyclopropanecarboxamide IUPAC Name: 1-phenyl-N-[2-(thian-4-yl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclopropane-1-carboxamide Traditional Name: 1-phenyl-N-(2-tetrahydrothiopyran-4-yl-3,4-dihydro-1H-isoquinolin-7-yl)cyclopropanecarboxamide Formula: C24H28N2OS MolecularWeight: 392.55692

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1N2CCC3=C(C2)C=C(C=C3)NC(=O)C4(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CSCCC1N2CCC3=C(C2)C=C(C=C3)NC(=O)C4(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H28N2OS/c27-23(24(11-12-24)20-4-2-1-3-5-20)25-21-7-6-18-8-13-26(17-19(18)16-21)22-9-14-28-15-10-22/h1-7,16,22H,8-15,17H2,(H,25,27)