(3R)-N-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Systemtic Name: (3R)-N-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Openeye Name: (3R)-N-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide CAS Name: (3R)-N-[4-(methylthio)phenyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide IUPAC Name: (3R)-N-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Traditional Name: (3R)-N-[4-(methylthio)phenyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)[C@H]2CC3=CC=CC=C3CN2

InChI

InChI=1S/C17H18N2OS/c1-21-15-8-6-14(7-9-15)19-17(20)16-10-12-4-2-3-5-13(12)11-18-16/h2-9,16,18H,10-11H2,1H3,(H,19,20)/t16-/m1/s1