6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-[4-(2-nitrophenyl)piperazin-1-yl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-[4-(2-nitrophenyl)piperazin-1-yl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-3-methyl-5-[2-[4-(2-nitrophenyl)piperazin-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[2-[4-(2-nitrophenyl)-1-piperazinyl]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[2-[4-(2-nitrophenyl)piperazin-1-yl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-3-methyl-5-[2-[4-(2-nitrophenyl)piperazino]acetyl]pyrimidine-2,4-quinone Formula: C21H28N6O5 MolecularWeight: 444.48422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])N

InChI

InChI=1S/C21H28N6O5/c1-14(2)12-26-19(22)18(20(29)23(3)21(26)30)17(28)13-24-8-10-25(11-9-24)15-6-4-5-7-16(15)27(31)32/h4-7,14H,8-13,22H2,1-3H3