4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]-N-phenyl-piperidine-1-carbothioamide

Systemtic Name: 4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]-N-phenyl-piperidine-1-carbothioamide Openeye Name: 4-[[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]methyl]-N-phenyl-piperidine-1-carbothioamide CAS Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]-N-phenyl-1-piperidinecarbothioamide IUPAC Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]-N-phenylpiperidine-1-carbothioamide Traditional Name: 4-[[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]methyl]-N-phenyl-piperidine-1-carbothioamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNCC2CCN(CC2)C(=S)NC3=CC=CC=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNCC2CCN(CC2)C(=S)NC3=CC=CC=C3)C(=O)C1)C

InChI

InChI=1S/C22H29N3O2S/c1-22(2)12-19(26)18(20(27)13-22)15-23-14-16-8-10-25(11-9-16)21(28)24-17-6-4-3-5-7-17/h3-7,15-16,23H,8-14H2,1-2H3,(H,24,28)