methanoic acid; 1-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl)urea

Systemtic Name: methanoic acid; 1-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl)urea Openeye Name: formic acid; 1-[6-(1-methylpyrazol-4-yl)-3-pyridyl]-3-[4-(1-piperidyl)butyl]urea CAS Name: formic acid; 1-[6-(1-methyl-4-pyrazolyl)-3-pyridinyl]-3-[4-(1-piperidinyl)butyl]urea IUPAC Name: formic acid; 1-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl)urea Traditional Name: formic acid; 1-[6-(1-methylpyrazol-4-yl)-3-pyridyl]-3-(4-piperidinobutyl)urea Formula: C20H30N6O3 MolecularWeight: 402.4906

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC=C(C=C2)NC(=O)NCCCCN3CCCCC3.C(=O)O

Isomeric SMILES

CN1C=C(C=N1)C2=NC=C(C=C2)NC(=O)NCCCCN3CCCCC3.C(=O)O

InChI

InChI=1S/C19H28N6O.CH2O2/c1-24-15-16(13-22-24)18-8-7-17(14-21-18)23-19(26)20-9-3-6-12-25-10-4-2-5-11-25;2-1-3/h7-8,13-15H,2-6,9-12H2,1H3,(H2,20,23,26);1H,(H,2,3)