4-chloranyl-N-[[4-methyl-5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[4-methyl-5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[4-methyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-chloro-N-[[4-methyl-5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-chloro-N-[[4-methyl-5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C25H20ClN5O2S2 MolecularWeight: 522.0416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CNC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CNC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H20ClN5O2S2/c1-30-22(14-27-24(33)16-10-12-17(26)13-11-16)28-29-25(30)34-15-23(32)31-18-6-2-4-8-20(18)35-21-9-5-3-7-19(21)31/h2-13H,14-15H2,1H3,(H,27,33)