4-(4-methoxyphenyl)-2-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)sulfanyl-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-2-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)sulfanyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-2-(3-oxo-3-phenothiazin-10-yl-propyl)sulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(4-methoxyphenyl)-2-[[3-oxo-3-(10-phenothiazinyl)propyl]thio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-2-(3-oxo-3-phenothiazin-10-ylpropyl)sulfanyl-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[(3-keto-3-phenothiazin-10-yl-propyl)thio]-4-(4-methoxyphenyl)-6-phenyl-nicotinonitrile Formula: C34H25N3O2S2 MolecularWeight: 571.7112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C34H25N3O2S2/c1-39-25-17-15-23(16-18-25)26-21-28(24-9-3-2-4-10-24)36-34(27(26)22-35)40-20-19-33(38)37-29-11-5-7-13-31(29)41-32-14-8-6-12-30(32)37/h2-18,21H,19-20H2,1H3