1-(1-ethylpyrazol-4-yl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea

Systemtic Name: 1-(1-ethylpyrazol-4-yl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Openeye Name: 1-(1-ethylpyrazol-4-yl)-3-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]urea CAS Name: 1-(1-ethyl-4-pyrazolyl)-3-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]urea IUPAC Name: 1-(1-ethylpyrazol-4-yl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Traditional Name: 1-(1-ethylpyrazol-4-yl)-3-[(2-pyrrolidino-4-pyridyl)methyl]urea Formula: C16H22N6O MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC(=O)NCC2=CC(=NC=C2)N3CCCC3

Isomeric SMILES

CCN1C=C(C=N1)NC(=O)NCC2=CC(=NC=C2)N3CCCC3

InChI

InChI=1S/C16H22N6O/c1-2-22-12-14(11-19-22)20-16(23)18-10-13-5-6-17-15(9-13)21-7-3-4-8-21/h5-6,9,11-12H,2-4,7-8,10H2,1H3,(H2,18,20,23)