(E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(3-nitrophenyl)acrylamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O4S/c1-3-31-17-8-5-9-18-21(17)24-22(32-18)26-19(12-14(2)25-26)23-20(28)11-10-15-6-4-7-16(13-15)27(29)30/h4-13H,3H2,1-2H3,(H,23,28)/b11-10+