N-[(3aS,7aS)-5,5-dimethyl-7-oxidanylidene-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(3aS,7aS)-5,5-dimethyl-7-oxidanylidene-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methyl-benzamide Openeye Name: N-[(3aS,7aS)-5,5-dimethyl-7-oxo-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methyl-benzamide CAS Name: N-[(3aS,7aS)-5,5-dimethyl-7-oxo-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methylbenzamide IUPAC Name: N-[(3aS,7aS)-5,5-dimethyl-7-oxo-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methylbenzamide Traditional Name: N-[(3aS,7aS)-7-keto-5,5-dimethyl-3a,4,6,7a-tetrahydro-1,3-benzothiazol-2-yl]-4-methyl-benzamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NC3CC(CC(=O)C3S2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=N[C@H]3CC(CC(=O)[C@H]3S2)(C)C

InChI

InChI=1S/C17H20N2O2S/c1-10-4-6-11(7-5-10)15(21)19-16-18-12-8-17(2,3)9-13(20)14(12)22-16/h4-7,12,14H,8-9H2,1-3H3,(H,18,19,21)/t12-,14-/m0/s1