(3R)-3-methyl-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-1-carbothioamide

Systemtic Name: (3R)-3-methyl-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-1-carbothioamide Openeye Name: (3R)-3-methyl-N-[4-(1-piperidylsulfonyl)phenyl]piperidine-1-carbothioamide CAS Name: (3R)-3-methyl-N-[4-(1-piperidinylsulfonyl)phenyl]-1-piperidinecarbothioamide IUPAC Name: (3R)-3-methyl-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-1-carbothioamide Traditional Name: (3R)-3-methyl-N-(4-piperidinosulfonylphenyl)piperidine-1-carbothioamide Formula: C18H27N3O2S2 MolecularWeight: 381.55588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H27N3O2S2/c1-15-6-5-11-20(14-15)18(24)19-16-7-9-17(10-8-16)25(22,23)21-12-3-2-4-13-21/h7-10,15H,2-6,11-14H2,1H3,(H,19,24)/t15-/m1/s1