2-[3-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[3-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[3-(1,1-diketo-1,2-thiazolidin-2-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(S(=O)(=O)C1)C2=CC=CC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

C1CN(S(=O)(=O)C1)C2=CC=CC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N

InChI

InChI=1S/C20H21N3O4S/c21-19(24)18-12-14-5-1-2-6-16(14)13-22(18)20(25)15-7-3-8-17(11-15)23-9-4-10-28(23,26)27/h1-3,5-8,11,18H,4,9-10,12-13H2,(H2,21,24)