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

Systemtic Name: N-[1-[4-ethyl-5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]-4-methyl-benzamide Openeye Name: N-[1-[4-ethyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]-4-methyl-benzamide CAS Name: N-[1-[4-ethyl-5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-4-methylbenzamide IUPAC Name: N-[1-[4-ethyl-5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]-4-methylbenzamide Traditional Name: N-[1-[4-ethyl-5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-1,2,4-triazol-3-yl]ethyl]-4-methyl-benzamide Formula: C28H27N5O2S2 MolecularWeight: 529.67628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C(C)NC(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C(C)NC(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H27N5O2S2/c1-4-32-26(19(3)29-27(35)20-15-13-18(2)14-16-20)30-31-28(32)36-17-25(34)33-21-9-5-7-11-23(21)37-24-12-8-6-10-22(24)33/h5-16,19H,4,17H2,1-3H3,(H,29,35)