(E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitrothiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitrothiophen-2-yl)prop-2-enamide Openeye Name: (E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitro-2-thienyl)prop-2-enamide CAS Name: (E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitro-2-thiophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitrothiophen-2-yl)prop-2-enamide Traditional Name: (E)-N-[2-(1,3-benzoxazol-2-yl)phenyl]-3-(5-nitro-2-thienyl)acrylamide Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3O2)NC(=O)C=CC4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3O2)NC(=O)/C=C/C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O4S/c24-18(11-9-13-10-12-19(28-13)23(25)26)21-15-6-2-1-5-14(15)20-22-16-7-3-4-8-17(16)27-20/h1-12H,(H,21,24)/b11-9+