N-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]carbothioylbenzamide

Systemtic Name: N-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]carbothioylbenzamide Openeye Name: N-(4,4-dimethyl-2,6-dioxo-cyclohexanecarbothioyl)benzamide CAS Name: N-[(4,4-dimethyl-2,6-dioxocyclohexyl)-sulfanylidenemethyl]benzamide IUPAC Name: N-(4,4-dimethyl-2,6-dioxocyclohexanecarbothioyl)benzamide Traditional Name: N-(2,6-diketo-4,4-dimethyl-cyclohexanecarbothioyl)benzamide Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=S)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(=S)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H17NO3S/c1-16(2)8-11(18)13(12(19)9-16)15(21)17-14(20)10-6-4-3-5-7-10/h3-7,13H,8-9H2,1-2H3,(H,17,20,21)