4-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3,5-dibromo-2-methoxy-phenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3,5-dibromo-2-methoxyphenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3,5-dibromo-2-methoxyphenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3,5-dibromo-2-methoxy-benzyl)amino]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H14Br2N4OS MolecularWeight: 470.18156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CNN2C(=NNC2=S)C3=CC=CC=C3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CNN2C(=NNC2=S)C3=CC=CC=C3)Br)Br

InChI

InChI=1S/C16H14Br2N4OS/c1-23-14-11(7-12(17)8-13(14)18)9-19-22-15(20-21-16(22)24)10-5-3-2-4-6-10/h2-8,19H,9H2,1H3,(H,21,24)