N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3,5-dimethyl-piperidine-1-carbothioamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3,5-dimethyl-piperidine-1-carbothioamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3,5-dimethyl-piperidine-1-carbothioamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3,5-dimethyl-1-piperidinecarbothioamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3,5-dimethylpiperidine-1-carbothioamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-3,5-dimethyl-piperidine-1-carbothioamide Formula: C21H33N3O2S2 MolecularWeight: 423.63562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CC(CC(C3)C)C)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CC(CC(C3)C)C)C

InChI

InChI=1S/C21H33N3O2S2/c1-15-12-16(2)14-23(13-15)21(27)22-19-8-10-20(11-9-19)28(25,26)24-17(3)6-5-7-18(24)4/h8-11,15-18H,5-7,12-14H2,1-4H3,(H,22,27)