(3R)-2-methylsulfonyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-methylsulfonyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-methylsulfonyl-N-[4-(2-thienyl)thiazol-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-methylsulfonyl-N-(4-thiophen-2-yl-2-thiazolyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-methylsulfonyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-mesyl-N-[4-(2-thienyl)thiazol-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=NC(=CS3)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)N1CC2=CC=CC=C2C[C@@H]1C(=O)NC3=NC(=CS3)C4=CC=CS4

InChI

InChI=1S/C18H17N3O3S3/c1-27(23,24)21-10-13-6-3-2-5-12(13)9-15(21)17(22)20-18-19-14(11-26-18)16-7-4-8-25-16/h2-8,11,15H,9-10H2,1H3,(H,19,20,22)/t15-/m1/s1