3-[4-methyl-3-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one

Systemtic Name: 3-[4-methyl-3-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Openeye Name: 3-[4-methyl-3-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one CAS Name: 3-[4-methyl-3-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1H-1,2,4-triazol-5-ylidene]-2-naphthalenone IUPAC Name: 3-[4-methyl-3-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Traditional Name: 3-[3-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-4-methyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Formula: C27H20N4O2S2 MolecularWeight: 496.6033

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

CN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C27H20N4O2S2/c1-30-26(19-14-17-8-2-3-9-18(17)15-22(19)32)28-29-27(30)34-16-25(33)31-20-10-4-6-12-23(20)35-24-13-7-5-11-21(24)31/h2-15,28H,16H2,1H3