N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-dioxothiolane-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-1,1-diketo-thiolane-3-carboxamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CCS(=O)(=O)C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CCS(=O)(=O)C4)C

InChI

InChI=1S/C20H20N2O3S2/c1-13-9-14(2)11-16(10-13)22(19(23)15-7-8-27(24,25)12-15)20-21-17-5-3-4-6-18(17)26-20/h3-6,9-11,15H,7-8,12H2,1-2H3