1-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-4-thiophen-2-yl-butan-1-one

Systemtic Name: 1-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-4-thiophen-2-yl-butan-1-one Openeye Name: 1-[3-(4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]-4-(2-thienyl)butan-1-one CAS Name: 1-[3-(4-methyl-1,2,4-triazol-3-yl)-1-piperidinyl]-4-thiophen-2-yl-1-butanone IUPAC Name: 1-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-4-thiophen-2-ylbutan-1-one Traditional Name: 1-[3-(4-methyl-1,2,4-triazol-3-yl)piperidino]-4-(2-thienyl)butan-1-one Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1C2CCCN(C2)C(=O)CCCC3=CC=CS3

Isomeric SMILES

CN1C=NN=C1C2CCCN(C2)C(=O)CCCC3=CC=CS3

InChI

InChI=1S/C16H22N4OS/c1-19-12-17-18-16(19)13-5-3-9-20(11-13)15(21)8-2-6-14-7-4-10-22-14/h4,7,10,12-13H,2-3,5-6,8-9,11H2,1H3