N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]phenyl]-3-imidazol-1-yl-propanamide

Systemtic Name: N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]phenyl]-3-imidazol-1-yl-propanamide Openeye Name: N-[3-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]phenyl]-3-imidazol-1-yl-propanamide CAS Name: N-[3-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]phenyl]-3-(1-imidazolyl)propanamide IUPAC Name: N-[3-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]phenyl]-3-imidazol-1-ylpropanamide Traditional Name: N-[3-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]phenyl]-3-imidazol-1-yl-propionamide Formula: C19H21N7O4 MolecularWeight: 411.41454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=CC(=C2)NC(=O)CCN3C=CN=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=CC(=C2)NC(=O)CCN3C=CN=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N7O4/c1-13-19(26(29)30)14(2)25(23-13)11-18(28)22-16-5-3-4-15(10-16)21-17(27)6-8-24-9-7-20-12-24/h3-5,7,9-10,12H,6,8,11H2,1-2H3,(H,21,27)(H,22,28)