N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(4-isopropylphenyl)methyl]-N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]piperazine-1-carbothioamide CAS Name: N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-4-[(4-propan-2-ylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(4-isopropylbenzyl)-N-[4-(4-methylpiperidino)sulfonylphenyl]piperazine-1-carbothioamide Formula: C27H38N4O2S2 MolecularWeight: 514.74622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)CC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)CC4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C27H38N4O2S2/c1-21(2)24-6-4-23(5-7-24)20-29-16-18-30(19-17-29)27(34)28-25-8-10-26(11-9-25)35(32,33)31-14-12-22(3)13-15-31/h4-11,21-22H,12-20H2,1-3H3,(H,28,34)