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

Systemtic Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-piperidyl]-3-methyl-butan-1-one CAS Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-piperidinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-3-methylbutan-1-one Traditional Name: 3-methyl-1-[4-(5-p-anisyl-1,3,4-thiadiazol-2-yl)piperidino]butan-1-one Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC(CC1)C2=NN=C(S2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CC(=O)N1CCC(CC1)C2=NN=C(S2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H27N3O2S/c1-14(2)12-19(24)23-10-8-16(9-11-23)20-22-21-18(26-20)13-15-4-6-17(25-3)7-5-15/h4-7,14,16H,8-13H2,1-3H3