[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

InChI

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