(3R)-1-oxidanylidene-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-1-oxidanylidene-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-1-oxo-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-1-keto-isochroman-3-carboxamide Formula: C19H15N3O3S2 MolecularWeight: 397.4707

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

C1[C@@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C19H15N3O3S2/c23-16(15-10-13-8-4-5-9-14(13)17(24)25-15)20-18-21-22-19(27-18)26-11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,21,23)/t15-/m1/s1