3,4-dimethoxy-N-[4-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[4-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]benzamide Openeye Name: 3,4-dimethoxy-N-[4-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]benzamide CAS Name: 3,4-dimethoxy-N-[4-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]phenyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[4-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylphenyl]benzamide Traditional Name: N-[4-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]phenyl]-3,4-dimethoxy-benzamide Formula: C29H24N2O4S2 MolecularWeight: 528.64186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

InChI

InChI=1S/C29H24N2O4S2/c1-34-24-16-11-19(17-25(24)35-2)29(33)30-20-12-14-21(15-13-20)36-18-28(32)31-22-7-3-5-9-26(22)37-27-10-6-4-8-23(27)31/h3-17H,18H2,1-2H3,(H,30,33)