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

Systemtic Name: 1-[3-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[3-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1-piperidyl]-2-phenyl-butan-1-one CAS Name: 1-[3-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-piperidinyl]-2-phenyl-1-butanone IUPAC Name: 1-[3-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[3-(5-isobutyl-1,3,4-thiadiazol-2-yl)piperidino]-2-phenyl-butan-1-one Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCCC(C2)C3=NN=C(S3)CC(C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCCC(C2)C3=NN=C(S3)CC(C)C

InChI

InChI=1S/C21H29N3OS/c1-4-18(16-9-6-5-7-10-16)21(25)24-12-8-11-17(14-24)20-23-22-19(26-20)13-15(2)3/h5-7,9-10,15,17-18H,4,8,11-14H2,1-3H3