1-cyano-3-[(1-methyl-4-pyridin-4-yl-pyrrol-2-yl)methyl]urea

Systemtic Name: 1-cyano-3-[(1-methyl-4-pyridin-4-yl-pyrrol-2-yl)methyl]urea Openeye Name: 1-cyano-3-[[1-methyl-4-(4-pyridyl)pyrrol-2-yl]methyl]urea CAS Name: 1-cyano-3-[(1-methyl-4-pyridin-4-yl-2-pyrrolyl)methyl]urea IUPAC Name: 1-cyano-3-[(1-methyl-4-pyridin-4-ylpyrrol-2-yl)methyl]urea Traditional Name: 1-cyano-3-[[1-methyl-4-(4-pyridyl)pyrrol-2-yl]methyl]urea Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1CNC(=O)NC#N)C2=CC=NC=C2

Isomeric SMILES

CN1C=C(C=C1CNC(=O)NC#N)C2=CC=NC=C2

InChI

InChI=1S/C13H13N5O/c1-18-8-11(10-2-4-15-5-3-10)6-12(18)7-16-13(19)17-9-14/h2-6,8H,7H2,1H3,(H2,16,17,19)