N-(3-chloranyl-4-methyl-phenyl)-2-[5-[2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[5-[2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[5-[2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[5-[[2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[5-[2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[5-[[2-keto-2-[(4-methyl-1,3-benzothiazol-2-yl)amino]ethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]acetamide Formula: C27H23ClN6O2S2 MolecularWeight: 563.09352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)CC(=O)NC5=CC(=C(C=C5)C)Cl

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)CC(=O)NC5=CC(=C(C=C5)C)Cl

InChI

InChI=1S/C27H23ClN6O2S2/c1-16-11-12-18(13-20(16)28)29-23(35)14-22-32-33-27(34(22)19-8-4-3-5-9-19)37-15-24(36)30-26-31-25-17(2)7-6-10-21(25)38-26/h3-13H,14-15H2,1-2H3,(H,29,35)(H,30,31,36)