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

Systemtic Name: 3-[4-(2-methoxyethyl)-3-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Openeye Name: 3-[4-(2-methoxyethyl)-3-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one CAS Name: 3-[4-(2-methoxyethyl)-3-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1H-1,2,4-triazol-5-ylidene]-2-naphthalenone IUPAC Name: 3-[4-(2-methoxyethyl)-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-(2-methoxyethyl)-1H-1,2,4-triazol-5-ylidene]naphthalen-2-one Formula: C29H24N4O3S2 MolecularWeight: 540.65586

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

COCCN1C(=C2C=C3C=CC=CC3=CC2=O)NN=C1SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C29H24N4O3S2/c1-36-15-14-32-28(21-16-19-8-2-3-9-20(19)17-24(21)34)30-31-29(32)37-18-27(35)33-22-10-4-6-12-25(22)38-26-13-7-5-11-23(26)33/h2-13,16-17,30H,14-15,18H2,1H3