N-(3-chloranyl-4-methyl-phenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-benzamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-benzamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]benzamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]benzamide Formula: C28H21ClN2O2S2 MolecularWeight: 517.06154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)Cl

InChI

InChI=1S/C28H21ClN2O2S2/c1-18-14-15-19(16-21(18)29)30-28(33)20-8-2-5-11-24(20)34-17-27(32)31-22-9-3-6-12-25(22)35-26-13-7-4-10-23(26)31/h2-16H,17H2,1H3,(H,30,33)