N-(3-chloranyl-2-methyl-6-oxidanyl-5-propan-2-yl-phenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-6-oxidanyl-5-propan-2-yl-phenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-hydroxy-3-isopropyl-6-methyl-phenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-hydroxy-6-methyl-3-propan-2-ylphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(5-chloro-2-hydroxy-6-methyl-3-propan-2-ylphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-hydroxy-3-isopropyl-6-methyl-phenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C)O)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C)O)C(C)C)Cl

InChI

InChI=1S/C21H23ClN4O2S/c1-12(2)16-10-17(22)13(3)19(20(16)28)23-18(27)11-29-21-25-24-14(4)26(21)15-8-6-5-7-9-15/h5-10,12,28H,11H2,1-4H3,(H,23,27)