4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperidin-1-yl)butan-1-one Openeye Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methyl-1-piperidyl)butan-1-one CAS Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(4-methyl-1-piperidinyl)-1-butanone IUPAC Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperidin-1-yl)butan-1-one Traditional Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(4-methylpiperidino)butan-1-one Formula: C19H26N4OS MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCCSC2=NN=C(N2C3=CC=CC=C3)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CCCSC2=NN=C(N2C3=CC=CC=C3)C

InChI

InChI=1S/C19H26N4OS/c1-15-10-12-22(13-11-15)18(24)9-6-14-25-19-21-20-16(2)23(19)17-7-4-3-5-8-17/h3-5,7-8,15H,6,9-14H2,1-2H3