5-[(3-bromophenyl)amino]-3-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(3-bromophenyl)amino]-3-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(3-bromoanilino)-3-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(3-bromoanilino)-3-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(3-bromoanilino)-3-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(3-bromoanilino)-3-[[methyl(p-anisyl)amino]methyl]-1,3,4-thiadiazole-2-thione Formula: C18H19BrN4OS2 MolecularWeight: 451.40366

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC)CN2C(=S)SC(=N2)NC3=CC(=CC=C3)Br

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC)CN2C(=S)SC(=N2)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H19BrN4OS2/c1-22(11-13-6-8-16(24-2)9-7-13)12-23-18(25)26-17(21-23)20-15-5-3-4-14(19)10-15/h3-10H,11-12H2,1-2H3,(H,20,21)