3-[[2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]propan-1-ol bromide

Systemtic Name: 3-[[2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]propan-1-ol bromide Openeye Name: 3-[[2-(m-tolyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]propan-1-ol bromide CAS Name: 3-[[2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]-1-propanol bromide IUPAC Name: 3-[[2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]propan-1-ol bromide Traditional Name: 3-[[2-(m-tolyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amino]propan-1-ol bromide Formula: C18H19BrN3OS- MolecularWeight: 405.33196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC(=NCCCO)S2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC(=NCCCO)S2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H19N3OS.BrH/c1-14-7-5-10-16(13-14)21-17(15-8-3-2-4-9-15)20-18(23-21)19-11-6-12-22;/h2-5,7-10,13,22H,6,11-12H2,1H3;1H/p-1