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

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-ethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-4-(4-ethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-4-(4-ethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-ethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-4-(4-ethylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C26H36N4O4S3 MolecularWeight: 564.78344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4C(CCCC4C)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4C(CCCC4C)C

InChI

InChI=1S/C26H36N4O4S3/c1-4-22-8-12-24(13-9-22)36(31,32)29-18-16-28(17-19-29)26(35)27-23-10-14-25(15-11-23)37(33,34)30-20(2)6-5-7-21(30)3/h8-15,20-21H,4-7,16-19H2,1-3H3,(H,27,35)