N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-keto-butyramide Formula: C22H29N5O4S2 MolecularWeight: 491.62676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H29N5O4S2/c28-19(23-22-25-24-21(32-22)17-7-3-1-4-8-17)11-12-20(29)26-13-15-27(16-14-26)33(30,31)18-9-5-2-6-10-18/h2,5-6,9-10,17H,1,3-4,7-8,11-16H2,(H,23,25,28)