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

Systemtic Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4-(3,4-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpyridine-3-carbonitrile Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-6-(p-tolyl)nicotinonitrile Formula: C35H27N3O3S2 MolecularWeight: 601.73718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C35H27N3O3S2/c1-22-12-14-23(15-13-22)27-19-25(24-16-17-30(40-2)31(18-24)41-3)26(20-36)35(37-27)42-21-34(39)38-28-8-4-6-10-32(28)43-33-11-7-5-9-29(33)38/h4-19H,21H2,1-3H3