6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-4-(p-tolyl)pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpyridine-3-carbonitrile Traditional Name: 2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-6-(4-methoxyphenyl)-4-(p-tolyl)nicotinonitrile Formula: C34H25N3O2S2 MolecularWeight: 571.7112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=C(C=C6)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=C(C=C6)OC

InChI

InChI=1S/C34H25N3O2S2/c1-22-11-13-23(14-12-22)26-19-28(24-15-17-25(39-2)18-16-24)36-34(27(26)20-35)40-21-33(38)37-29-7-3-5-9-31(29)41-32-10-6-4-8-30(32)37/h3-19H,21H2,1-2H3