N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Openeye Name: N-[1-(p-tolylsulfonyl)-4-piperidyl]-4-(3-thienylmethyl)piperazine-1-carboxamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-4-(3-thiophenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Traditional Name: 4-(3-thenyl)-N-(1-tosyl-4-piperidyl)piperazine-1-carboxamide Formula: C22H30N4O3S2 MolecularWeight: 462.6286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C22H30N4O3S2/c1-18-2-4-21(5-3-18)31(28,29)26-9-6-20(7-10-26)23-22(27)25-13-11-24(12-14-25)16-19-8-15-30-17-19/h2-5,8,15,17,20H,6-7,9-14,16H2,1H3,(H,23,27)