4-[2,4-bis(oxidanyl)phenyl]-2-diazanyl-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide

Systemtic Name: 4-[2,4-bis(oxidanyl)phenyl]-2-diazanyl-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide Openeye Name: 4-(2,4-dihydroxyphenyl)-2-hydrazino-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide CAS Name: 4-(2,4-dihydroxyphenyl)-2-hydrazinyl-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide IUPAC Name: 4-(2,4-dihydroxyphenyl)-2-hydrazinyl-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide Traditional Name: 4-(2,4-dihydroxyphenyl)-2-hydrazino-6-methyl-N-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxamide Formula: C18H18N6O5 MolecularWeight: 398.37272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)NN)C2=C(C=C(C=C2)O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(N=C(N1)NN)C2=C(C=C(C=C2)O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O5/c1-9-15(17(27)21-10-3-2-4-11(7-10)24(28)29)16(22-18(20-9)23-19)13-6-5-12(25)8-14(13)26/h2-8,16,25-26H,19H2,1H3,(H,21,27)(H2,20,22,23)