(5S)-2-(4-bromophenyl)imino-5-[(3-nitrophenyl)methyl]-5H-1,3-thiazol-4-olate

Systemtic Name: (5S)-2-(4-bromophenyl)imino-5-[(3-nitrophenyl)methyl]-5H-1,3-thiazol-4-olate Openeye Name: (5S)-2-(4-bromophenyl)imino-5-[(3-nitrophenyl)methyl]-5H-thiazol-4-olate CAS Name: (5S)-2-(4-bromophenyl)imino-5-[(3-nitrophenyl)methyl]-5H-thiazol-4-olate IUPAC Name: (5S)-2-(4-bromophenyl)imino-5-[(3-nitrophenyl)methyl]-5H-1,3-thiazol-4-olate Traditional Name: (5S)-2-(4-bromophenyl)imino-5-(3-nitrobenzyl)-3-thiazolin-4-olate Formula: C16H11BrN3O3S- MolecularWeight: 405.24584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CC2C(=NC(=NC3=CC=C(C=C3)Br)S2)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C[C@H]2C(=NC(=NC3=CC=C(C=C3)Br)S2)[O-]

InChI

InChI=1S/C16H12BrN3O3S/c17-11-4-6-12(7-5-11)18-16-19-15(21)14(24-16)9-10-2-1-3-13(8-10)20(22)23/h1-8,14H,9H2,(H,18,19,21)/p-1/t14-/m0/s1