1-(4-methylphenyl)-3-[3-[(4-methylphenyl)carbamoylamino]-4-nitro-phenyl]urea

Systemtic Name: 1-(4-methylphenyl)-3-[3-[(4-methylphenyl)carbamoylamino]-4-nitro-phenyl]urea Openeye Name: 1-[2-nitro-5-(p-tolylcarbamoylamino)phenyl]-3-(p-tolyl)urea CAS Name: 1-[3-[[(4-methylanilino)-oxomethyl]amino]-4-nitrophenyl]-3-(4-methylphenyl)urea IUPAC Name: 1-(4-methylphenyl)-3-[3-[(4-methylphenyl)carbamoylamino]-4-nitrophenyl]urea Traditional Name: 1-[2-nitro-5-(p-tolylcarbamoylamino)phenyl]-3-(p-tolyl)urea Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C22H21N5O4/c1-14-3-7-16(8-4-14)23-21(28)25-18-11-12-20(27(30)31)19(13-18)26-22(29)24-17-9-5-15(2)6-10-17/h3-13H,1-2H3,(H2,23,25,28)(H2,24,26,29)