1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-piperidyl]-2-phenyl-butan-1-one CAS Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-piperidinyl]-2-phenyl-1-butanone IUPAC Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[4-(5-p-anisyl-1,3,4-thiadiazol-2-yl)piperidino]-2-phenyl-butan-1-one Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCC(CC2)C3=NN=C(S3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCC(CC2)C3=NN=C(S3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29N3O2S/c1-3-22(19-7-5-4-6-8-19)25(29)28-15-13-20(14-16-28)24-27-26-23(31-24)17-18-9-11-21(30-2)12-10-18/h4-12,20,22H,3,13-17H2,1-2H3