(3S)-2-(3-methylquinolin-8-yl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-(3-methylquinolin-8-yl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[(3-methyl-8-quinolyl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[(3-methyl-8-quinolinyl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-(3-methylquinolin-8-yl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[(3-methyl-8-quinolyl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CC4=CC=CC=C4C[C@H]3C(=O)N

InChI

InChI=1S/C20H19N3O3S/c1-13-9-15-7-4-8-18(19(15)22-11-13)27(25,26)23-12-16-6-3-2-5-14(16)10-17(23)20(21)24/h2-9,11,17H,10,12H2,1H3,(H2,21,24)/t17-/m0/s1