3-[(3-chloranyl-4-ethoxy-phenyl)methyl]-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-[(3-chloranyl-4-ethoxy-phenyl)methyl]-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-[(3-chloro-4-ethoxy-phenyl)methyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(3-chloro-4-ethoxyphenyl)methyl]-4-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-[(3-chloro-4-ethoxyphenyl)methyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(3-chloro-4-ethoxy-benzyl)-4-methyl-1,2,4-triazole Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2=NN=C(N2C)SCC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2=NN=C(N2C)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-3-24-17-10-9-15(11-16(17)20)12-18-21-22-19(23(18)2)25-13-14-7-5-4-6-8-14/h4-11H,3,12-13H2,1-2H3