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

Systemtic Name: 3-[4-(2-methoxyethyl)-3-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Openeye Name: 3-[4-(2-methoxyethyl)-3-[2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one CAS Name: 3-[4-(2-methoxyethyl)-3-[[2-[(2R)-2-methyl-1-piperidinyl]-2-oxoethyl]thio]-1H-1,2,4-triazol-5-ylidene]-2-naphthalenone IUPAC Name: 3-[4-(2-methoxyethyl)-3-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Traditional Name: 3-[3-[[2-keto-2-[(2R)-2-methylpiperidino]ethyl]thio]-4-(2-methoxyethyl)-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NNC(=C3C=C4C=CC=CC4=CC3=O)N2CCOC

Isomeric SMILES

C[C@@H]1CCCCN1C(=O)CSC2=NNC(=C3C=C4C=CC=CC4=CC3=O)N2CCOC

InChI

InChI=1S/C23H28N4O3S/c1-16-7-5-6-10-26(16)21(29)15-31-23-25-24-22(27(23)11-12-30-2)19-13-17-8-3-4-9-18(17)14-20(19)28/h3-4,8-9,13-14,16,24H,5-7,10-12,15H2,1-2H3/t16-/m1/s1