N-(5-chloranyl-2-methoxy-phenyl)-3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide Openeye Name: 3-(5-benzyl-1,3,4-thiadiazol-2-yl)-N-(5-chloro-2-methoxy-phenyl)piperidine-1-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1-piperidinecarboxamide IUPAC Name: 3-(5-benzyl-1,3,4-thiadiazol-2-yl)-N-(5-chloro-2-methoxyphenyl)piperidine-1-carboxamide Traditional Name: 3-(5-benzyl-1,3,4-thiadiazol-2-yl)-N-(5-chloro-2-methoxy-phenyl)piperidine-1-carboxamide Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)N2CCCC(C2)C3=NN=C(S3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)N2CCCC(C2)C3=NN=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O2S/c1-29-19-10-9-17(23)13-18(19)24-22(28)27-11-5-8-16(14-27)21-26-25-20(30-21)12-15-6-3-2-4-7-15/h2-4,6-7,9-10,13,16H,5,8,11-12,14H2,1H3,(H,24,28)