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

Systemtic Name: methanoic acid; 1-(4-piperidin-1-ylbutyl)-3-[6-(1H-pyrazol-4-yl)pyridin-3-yl]urea Openeye Name: formic acid; 1-[4-(1-piperidyl)butyl]-3-[6-(1H-pyrazol-4-yl)-3-pyridyl]urea CAS Name: formic acid; 1-[4-(1-piperidinyl)butyl]-3-[6-(1H-pyrazol-4-yl)-3-pyridinyl]urea IUPAC Name: formic acid; 1-(4-piperidin-1-ylbutyl)-3-[6-(1H-pyrazol-4-yl)pyridin-3-yl]urea Traditional Name: formic acid; 1-(4-piperidinobutyl)-3-[6-(1H-pyrazol-4-yl)-3-pyridyl]urea Formula: C19H28N6O3 MolecularWeight: 388.46402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCNC(=O)NC2=CN=C(C=C2)C3=CNN=C3.C(=O)O

Isomeric SMILES

C1CCN(CC1)CCCCNC(=O)NC2=CN=C(C=C2)C3=CNN=C3.C(=O)O

InChI

InChI=1S/C18H26N6O.CH2O2/c25-18(19-8-2-5-11-24-9-3-1-4-10-24)23-16-6-7-17(20-14-16)15-12-21-22-13-15;2-1-3/h6-7,12-14H,1-5,8-11H2,(H,21,22)(H2,19,23,25);1H,(H,2,3)