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

Systemtic Name: 4-[[3,5-bis(bromanyl)-2-ethoxy-phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3,5-dibromo-2-ethoxy-phenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3,5-dibromo-2-ethoxyphenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3,5-dibromo-2-ethoxyphenyl)methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3,5-dibromo-2-ethoxy-benzyl)amino]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C17H16Br2N4OS MolecularWeight: 484.20814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1CNN2C(=NNC2=S)C3=CC=CC=C3)Br)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1CNN2C(=NNC2=S)C3=CC=CC=C3)Br)Br

InChI

InChI=1S/C17H16Br2N4OS/c1-2-24-15-12(8-13(18)9-14(15)19)10-20-23-16(21-22-17(23)25)11-6-4-3-5-7-11/h3-9,20H,2,10H2,1H3,(H,22,25)