(E)-N-(4-bromanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-bromanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(4-bromo-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(4-bromo-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-bromo-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-bromo-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)acrylamide Formula: C16H10BrN3O3S MolecularWeight: 404.2379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC2=NC3=C(S2)C=CC=C3Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC2=NC3=C(S2)C=CC=C3Br

InChI

InChI=1S/C16H10BrN3O3S/c17-12-5-2-6-13-15(12)19-16(24-13)18-14(21)8-7-10-3-1-4-11(9-10)20(22)23/h1-9H,(H,18,19,21)/b8-7+