1-(2-methyl-5-nitro-phenyl)-3-[2-[(2-propanoylphenyl)carbamoylamino]ethanoylamino]urea

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)-3-[2-[(2-propanoylphenyl)carbamoylamino]ethanoylamino]urea Openeye Name: 1-(2-methyl-5-nitro-phenyl)-3-[[2-[(2-propanoylphenyl)carbamoylamino]acetyl]amino]urea CAS Name: 1-[2-[[(2-methyl-5-nitroanilino)-oxomethyl]hydrazo]-2-oxoethyl]-3-[2-(1-oxopropyl)phenyl]urea IUPAC Name: 1-(2-methyl-5-nitrophenyl)-3-[[2-[(2-propanoylphenyl)carbamoylamino]acetyl]amino]urea Traditional Name: 1-[2-keto-2-[N'-[(2-methyl-5-nitro-phenyl)carbamoyl]hydrazino]ethyl]-3-(2-propionylphenyl)urea Formula: C20H22N6O6 MolecularWeight: 442.42528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1NC(=O)NCC(=O)NNC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)C1=CC=CC=C1NC(=O)NCC(=O)NNC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N6O6/c1-3-17(27)14-6-4-5-7-15(14)22-19(29)21-11-18(28)24-25-20(30)23-16-10-13(26(31)32)9-8-12(16)2/h4-10H,3,11H2,1-2H3,(H,24,28)(H2,21,22,29)(H2,23,25,30)