(3R)-3-methyl-1-oxidanylidene-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4H-isochromene-3-carboxamide

Systemtic Name: (3R)-3-methyl-1-oxidanylidene-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4H-isochromene-3-carboxamide Openeye Name: (3R)-N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-3-methyl-1-oxo-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-3-methyl-1-oxo-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-4H-isochromene-3-carboxamide Traditional Name: (3R)-N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S2/c1-3-8-23-15-19-18-14(24-15)17-13(21)16(2)9-10-6-4-5-7-11(10)12(20)22-16/h3-7H,1,8-9H2,2H3,(H,17,18,21)/t16-/m1/s1