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

Systemtic Name: 1-(4-methylpentyl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Openeye Name: 1-isohexyl-3-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]urea CAS Name: 1-(4-methylpentyl)-3-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]urea IUPAC Name: 1-(4-methylpentyl)-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Traditional Name: 1-isohexyl-3-[(2-pyrrolidino-4-pyridyl)methyl]urea Formula: C17H28N4O MolecularWeight: 304.43042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNC(=O)NCC1=CC(=NC=C1)N2CCCC2

Isomeric SMILES

CC(C)CCCNC(=O)NCC1=CC(=NC=C1)N2CCCC2

InChI

InChI=1S/C17H28N4O/c1-14(2)6-5-8-19-17(22)20-13-15-7-9-18-16(12-15)21-10-3-4-11-21/h7,9,12,14H,3-6,8,10-11,13H2,1-2H3,(H2,19,20,22)