1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-3-(2-nitrophenyl)urea

Systemtic Name: 1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-3-(2-nitrophenyl)urea Openeye Name: 1-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]-3-(2-nitrophenyl)urea CAS Name: 1-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-3-(2-nitrophenyl)urea IUPAC Name: 1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-3-(2-nitrophenyl)urea Traditional Name: 1-[[6-(4-methylpiperazino)-3-pyridyl]methyl]-3-(2-nitrophenyl)urea Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O3/c1-22-8-10-23(11-9-22)17-7-6-14(12-19-17)13-20-18(25)21-15-4-2-3-5-16(15)24(26)27/h2-7,12H,8-11,13H2,1H3,(H2,20,21,25)