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

Systemtic Name: 4,6-bis(4-methoxyphenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-bis(4-methoxyphenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-bis(4-methoxyphenyl)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-bis(4-methoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpyridine-3-carbonitrile Traditional Name: 2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-4,6-bis(4-methoxyphenyl)nicotinonitrile Formula: C34H25N3O3S2 MolecularWeight: 587.7106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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

COC1=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/C34H25N3O3S2/c1-39-24-15-11-22(12-16-24)26-19-28(23-13-17-25(40-2)18-14-23)36-34(27(26)20-35)41-21-33(38)37-29-7-3-5-9-31(29)42-32-10-6-4-8-30(32)37/h3-19H,21H2,1-2H3