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

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[5-(2-furyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[5-(2-furanyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[4-(2-furfuryl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CO4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CO4

InChI

InChI=1S/C21H19ClN4O4S/c1-13-9-16(18(28-2)10-15(13)22)23-19(27)12-31-21-25-24-20(17-6-4-8-30-17)26(21)11-14-5-3-7-29-14/h3-10H,11-12H2,1-2H3,(H,23,27)