3-[(2-chlorophenyl)methylsulfanyl]-N-[(4-prop-2-enoxyphenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-N-[(4-prop-2-enoxyphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: N-[(4-allyloxyphenyl)methyl]-3-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-chlorophenyl)methylthio]-N-[(4-prop-2-enoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-N-[(4-prop-2-enoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: (4-allyloxybenzyl)-[3-[(2-chlorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C19H19ClN4OS MolecularWeight: 386.89836

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3Cl

Isomeric SMILES

C=CCOC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3Cl

InChI

InChI=1S/C19H19ClN4OS/c1-2-11-25-17-9-7-15(8-10-17)12-22-24-14-21-23-19(24)26-13-16-5-3-4-6-18(16)20/h2-10,14,22H,1,11-13H2