3-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole

Systemtic Name: 3-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[[(4-chlorophenyl)-phenylmethyl]thio]-4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)-phenylmethyl]sulfanyl-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[[(4-chlorophenyl)-phenyl-methyl]thio]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN3OS/c1-14-18(12-13-26-14)20-23-24-21(25(20)2)27-19(15-6-4-3-5-7-15)16-8-10-17(22)11-9-16/h3-13,19H,1-2H3