2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole

Systemtic Name: 2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole Openeye Name: 2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]-1,3,4-thiadiazole CAS Name: 2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinyl]-1,3,4-thiadiazole IUPAC Name: 2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidin-4-yl]-1,3,4-thiadiazole Traditional Name: 2-(cyclopentylmethyl)-5-[1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]-1,3,4-thiadiazole Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C3=NN=C(S3)CC4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C3=NN=C(S3)CC4CCCC4

InChI

InChI=1S/C21H29N3O3S2/c1-15-7-8-18(27-2)19(13-15)29(25,26)24-11-9-17(10-12-24)21-23-22-20(28-21)14-16-5-3-4-6-16/h7-8,13,16-17H,3-6,9-12,14H2,1-2H3