N-[cyclohexyl-(2-oxidanylidenecyclohexyl)methyl]benzenecarbothioamide

Systemtic Name: N-[cyclohexyl-(2-oxidanylidenecyclohexyl)methyl]benzenecarbothioamide Openeye Name: N-[cyclohexyl-(2-oxocyclohexyl)methyl]benzenecarbothioamide CAS Name: N-[cyclohexyl-(2-oxocyclohexyl)methyl]benzenecarbothioamide IUPAC Name: N-[cyclohexyl-(2-oxocyclohexyl)methyl]benzenecarbothioamide Traditional Name: N-[cyclohexyl-(2-ketocyclohexyl)methyl]thiobenzamide Formula: C20H27NOS MolecularWeight: 329.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2CCCCC2=O)NC(=S)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(C2CCCCC2=O)NC(=S)C3=CC=CC=C3

InChI

InChI=1S/C20H27NOS/c22-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)21-20(23)16-11-5-2-6-12-16/h2,5-6,11-12,15,17,19H,1,3-4,7-10,13-14H2,(H,21,23)