N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-4-(4-isopropylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-propan-2-ylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-4-p-cumenylsulfonyl-piperazine-1-carbothioamide Formula: C27H38N4O4S3 MolecularWeight: 578.81002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C)C

InChI

InChI=1S/C27H38N4O4S3/c1-20(2)23-8-12-25(13-9-23)37(32,33)30-18-16-29(17-19-30)27(36)28-24-10-14-26(15-11-24)38(34,35)31-21(3)6-5-7-22(31)4/h8-15,20-22H,5-7,16-19H2,1-4H3,(H,28,36)