4-[[4-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[1-[(5-methyl-2-thienyl)sulfonyl]nipecotoyl]piperazino]methyl]benzonitrile Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H28N4O3S2/c1-18-4-9-22(31-18)32(29,30)27-10-2-3-21(17-27)23(28)26-13-11-25(12-14-26)16-20-7-5-19(15-24)6-8-20/h4-9,21H,2-3,10-14,16-17H2,1H3