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

Systemtic Name: 2,4-bis(chloranyl)-N-[1-[5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butyl]benzamide Openeye Name: 2,4-dichloro-N-[1-[5-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butyl]benzamide CAS Name: 2,4-dichloro-N-[1-[5-[[2-(cyclopentylamino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]-3-methylbutyl]benzamide IUPAC Name: 2,4-dichloro-N-[1-[5-[2-(cyclopentylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-3-methylbutyl]benzamide Traditional Name: 2,4-dichloro-N-[1-[5-[[2-(cyclopentylamino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butyl]benzamide Formula: C22H29Cl2N5O2S MolecularWeight: 498.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=C(N1C)SCC(=O)NC2CCCC2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)CC(C1=NN=C(N1C)SCC(=O)NC2CCCC2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H29Cl2N5O2S/c1-13(2)10-18(26-21(31)16-9-8-14(23)11-17(16)24)20-27-28-22(29(20)3)32-12-19(30)25-15-6-4-5-7-15/h8-9,11,13,15,18H,4-7,10,12H2,1-3H3,(H,25,30)(H,26,31)