3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(4-benzylpiperidino)-2-keto-ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O2S/c1-2-10-23-18(25)20-21-19(23)26-14-17(24)22-11-8-16(9-12-22)13-15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H,20,25)