3-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-5-(naphthalen-1-yloxymethyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-5-(naphthalen-1-yloxymethyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-5-(1-naphthyloxymethyl)-1,2,4-triazole CAS Name: 3-[(3-bromo-4-methoxyphenyl)methylthio]-5-(1-naphthalenyloxymethyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-(naphthalen-1-yloxymethyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3-bromo-4-methoxy-benzyl)thio]-5-(1-naphthoxymethyl)-1,2,4-triazole Formula: C24H22BrN3O2S MolecularWeight: 496.41938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(N2CC=C)COC3=CC=CC4=CC=CC=C43)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(N2CC=C)COC3=CC=CC4=CC=CC=C43)Br

InChI

InChI=1S/C24H22BrN3O2S/c1-3-13-28-23(15-30-21-10-6-8-18-7-4-5-9-19(18)21)26-27-24(28)31-16-17-11-12-22(29-2)20(25)14-17/h3-12,14H,1,13,15-16H2,2H3