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

Systemtic Name: N-[1-[4-ethyl-5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-[1-[4-ethyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[1-[4-ethyl-5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-[1-[4-ethyl-5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide Traditional Name: N-[1-[4-ethyl-5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide Formula: C30H31N5O2S2 MolecularWeight: 557.72944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H31N5O2S2/c1-5-34-28(27(19(2)3)31-29(37)21-16-14-20(4)15-17-21)32-33-30(34)38-18-26(36)35-22-10-6-8-12-24(22)39-25-13-9-7-11-23(25)35/h6-17,19,27H,5,18H2,1-4H3,(H,31,37)