4-[4-(4-bromophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-(4-bromophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(4-bromophenyl)-5-(2-methylallylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-bromophenyl)-5-(2-methylprop-2-enylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(4-bromophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-(4-bromophenyl)-5-(2-methylallylthio)-1,2,4-triazol-3-yl]pyridine Formula: C17H15BrN4S MolecularWeight: 387.2968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CC=NC=C3

Isomeric SMILES

CC(=C)CSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CC=NC=C3

InChI

InChI=1S/C17H15BrN4S/c1-12(2)11-23-17-21-20-16(13-7-9-19-10-8-13)22(17)15-5-3-14(18)4-6-15/h3-10H,1,11H2,2H3