[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [3-methyl-4-(4-methylphenyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [3-methyl-4-(p-tolyl)piperazin-1-yl]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone CAS Name: [3-methyl-4-(4-methylphenyl)-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone IUPAC Name: [3-methyl-4-(4-methylphenyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [3-methyl-4-(p-tolyl)piperazino]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone Formula: C22H29N3O3S2 MolecularWeight: 447.61396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H29N3O3S2/c1-17-5-7-20(8-6-17)25-14-13-23(16-18(25)2)22(26)19-9-11-24(12-10-19)30(27,28)21-4-3-15-29-21/h3-8,15,18-19H,9-14,16H2,1-2H3