1-(4-methylphenyl)sulfonyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Openeye Name: N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Traditional Name: N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1-tosyl-isonipecotamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)COC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O4S2/c1-16-7-9-19(10-8-16)32(28,29)26-13-11-17(12-14-26)21(27)23-22-25-24-20(31-22)15-30-18-5-3-2-4-6-18/h2-10,17H,11-15H2,1H3,(H,23,25,27)