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

Systemtic Name: 2-chloranyl-N-[1-[5-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: 2-chloro-N-[1-[5-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: 2-chloro-N-[1-[5-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 2-chloro-N-[1-[5-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: 2-chloro-N-[1-[5-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C21H21Cl2N5O2S MolecularWeight: 478.39474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CC=C3Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C21H21Cl2N5O2S/c1-12-8-9-14(10-17(12)23)25-18(29)11-31-21-27-26-19(28(21)3)13(2)24-20(30)15-6-4-5-7-16(15)22/h4-10,13H,11H2,1-3H3,(H,24,30)(H,25,29)