2-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[5-(4-tert-butylphenyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[[5-(4-tert-butylphenyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-(4-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-chloro-2-methylphenyl)acetamide Traditional Name: 2-[[5-(4-tert-butylphenyl)-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-(4-chloro-2-methyl-phenyl)acetamide Formula: C26H27ClN4O2S MolecularWeight: 495.03618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H27ClN4O2S/c1-17-14-20(27)11-12-22(17)28-23(32)16-34-25-30-29-24(31(25)15-21-6-5-13-33-21)18-7-9-19(10-8-18)26(2,3)4/h5-14H,15-16H2,1-4H3,(H,28,32)