1-[(1-methylpyrrol-2-yl)carbonylamino]-3-[2-[(5-nitropyridin-2-yl)amino]ethyl]urea

Systemtic Name: 1-[(1-methylpyrrol-2-yl)carbonylamino]-3-[2-[(5-nitropyridin-2-yl)amino]ethyl]urea Openeye Name: 1-[(1-methylpyrrole-2-carbonyl)amino]-3-[2-[(5-nitro-2-pyridyl)amino]ethyl]urea CAS Name: 1-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-3-[2-[(5-nitro-2-pyridinyl)amino]ethyl]urea IUPAC Name: 1-[(1-methylpyrrole-2-carbonyl)amino]-3-[2-[(5-nitropyridin-2-yl)amino]ethyl]urea Traditional Name: 1-[(1-methylpyrrole-2-carbonyl)amino]-3-[2-[(5-nitro-2-pyridyl)amino]ethyl]urea Formula: C14H17N7O4 MolecularWeight: 347.32928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NNC(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C(=O)NNC(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N7O4/c1-20-8-2-3-11(20)13(22)18-19-14(23)16-7-6-15-12-5-4-10(9-17-12)21(24)25/h2-5,8-9H,6-7H2,1H3,(H,15,17)(H,18,22)(H2,16,19,23)