(3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-(4-cyanophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C#N)C(=O)N

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C#N)C(=O)N

InChI

InChI=1S/C17H15N3O3S/c18-10-12-5-7-15(8-6-12)24(22,23)20-11-14-4-2-1-3-13(14)9-16(20)17(19)21/h1-8,16H,9,11H2,(H2,19,21)/t16-/m0/s1