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

Systemtic Name: 4-(4-chlorophenyl)-6-(4-methylphenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(4-methylphenyl)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-6-(4-methylphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpyridine-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-6-(p-tolyl)nicotinonitrile Formula: C33H22ClN3OS2 MolecularWeight: 576.13028

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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)Cl)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)Cl)C#N)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C33H22ClN3OS2/c1-21-10-12-23(13-11-21)27-18-25(22-14-16-24(34)17-15-22)26(19-35)33(36-27)39-20-32(38)37-28-6-2-4-8-30(28)40-31-9-5-3-7-29(31)37/h2-18H,20H2,1H3