1-methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-(2-oxidanylideneazepan-3-yl)urea

Systemtic Name: 1-methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-(2-oxidanylideneazepan-3-yl)urea Openeye Name: 1-methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-(2-oxoazepan-3-yl)urea CAS Name: 1-methyl-1-[(1-methyl-4-pyrazolyl)methyl]-3-(2-oxo-3-azepanyl)urea IUPAC Name: 1-methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-(2-oxoazepan-3-yl)urea Traditional Name: 3-(2-ketoazepan-3-yl)-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)C(=O)NC2CCCCNC2=O

Isomeric SMILES

CN1C=C(C=N1)CN(C)C(=O)NC2CCCCNC2=O

InChI

InChI=1S/C13H21N5O2/c1-17(8-10-7-15-18(2)9-10)13(20)16-11-5-3-4-6-14-12(11)19/h7,9,11H,3-6,8H2,1-2H3,(H,14,19)(H,16,20)