(3R)-3-methyl-1-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-4H-isochromene-3-carboxamide

Systemtic Name: (3R)-3-methyl-1-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-4H-isochromene-3-carboxamide Openeye Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-3-methyl-1-oxo-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-keto-3-methyl-isochroman-3-carboxamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NN=C(S3)CC4=CC=CC=C4

Isomeric SMILES

C[C@@]1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NN=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S/c1-20(12-14-9-5-6-10-15(14)17(24)26-20)18(25)21-19-23-22-16(27-19)11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,21,23,25)/t20-/m1/s1