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

Systemtic Name: 3-methyl-N-[1-[4-methyl-5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: 3-methyl-N-[1-[4-methyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: 3-methyl-N-[1-[4-methyl-5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 3-methyl-N-[1-[4-methyl-5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-3-methyl-benzamide Formula: C27H25N5O2S2 MolecularWeight: 515.6497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C2=NN=C(N2C)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C)C2=NN=C(N2C)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C27H25N5O2S2/c1-17-9-8-10-19(15-17)26(34)28-18(2)25-29-30-27(31(25)3)35-16-24(33)32-20-11-4-6-13-22(20)36-23-14-7-5-12-21(23)32/h4-15,18H,16H2,1-3H3,(H,28,34)