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

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(4-benzylpiperazino)-2-keto-ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H25N5O2S/c1-2-8-23-17(25)19-20-18(23)26-14-16(24)22-11-9-21(10-12-22)13-15-6-4-3-5-7-15/h3-7H,2,8-14H2,1H3,(H,19,25)