4-(2-methylpiperidin-1-yl)sulfonyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-[(2-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: 4-[(2-methyl-1-piperidinyl)sulfonyl]-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(2-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-(2-methylpiperidino)sulfonyl-benzamide Formula: C22H24N4O3S3 MolecularWeight: 488.64596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S3/c1-16-7-5-6-14-26(16)32(28,29)19-12-10-18(11-13-19)20(27)23-21-24-25-22(31-21)30-15-17-8-3-2-4-9-17/h2-4,8-13,16H,5-7,14-15H2,1H3,(H,23,24,27)