3-[4-ethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one

Systemtic Name: 3-[4-ethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Openeye Name: 3-[4-ethyl-3-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one CAS Name: 3-[4-ethyl-3-[[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl]thio]-1H-1,2,4-triazol-5-ylidene]-2-naphthalenone IUPAC Name: 3-[4-ethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Traditional Name: 3-[4-ethyl-3-[[2-keto-2-[(2S)-2-methylpiperidino]ethyl]thio]-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4CCCCC4C

Isomeric SMILES

CCN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4CCCC[C@@H]4C

InChI

InChI=1S/C22H26N4O2S/c1-3-25-21(18-12-16-9-4-5-10-17(16)13-19(18)27)23-24-22(25)29-14-20(28)26-11-7-6-8-15(26)2/h4-5,9-10,12-13,15,23H,3,6-8,11,14H2,1-2H3/t15-/m0/s1