4-(3-bromophenyl)-N-(2-nitrophenyl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-3-ium-2-amine

Systemtic Name: 4-(3-bromophenyl)-N-(2-nitrophenyl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-3-ium-2-amine Openeye Name: 4-(3-bromophenyl)-N-(2-nitrophenyl)-3-[(Z)-2-pyridylmethyleneamino]thiazol-3-ium-2-amine CAS Name: 4-(3-bromophenyl)-N-(2-nitrophenyl)-3-[(Z)-2-pyridinylmethylideneamino]-2-thiazol-3-iumamine IUPAC Name: 4-(3-bromophenyl)-N-(2-nitrophenyl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-3-ium-2-amine Traditional Name: [4-(3-bromophenyl)-3-[(Z)-2-pyridylmethyleneamino]thiazol-3-ium-2-yl]-(2-nitrophenyl)amine Formula: C21H15BrN5O2S+ MolecularWeight: 481.3451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=[N+](C(=CS2)C3=CC(=CC=C3)Br)N=CC4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC2=[N+](C(=CS2)C3=CC(=CC=C3)Br)/N=C\C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C21H14BrN5O2S/c22-16-7-5-6-15(12-16)20-14-30-21(25-18-9-1-2-10-19(18)27(28)29)26(20)24-13-17-8-3-4-11-23-17/h1-14H/p+1/b24-13-