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

Systemtic Name: methanoic acid; 1-[6-(6-methoxypyridin-3-yl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl)urea Openeye Name: formic acid; 1-[6-(6-methoxy-3-pyridyl)-3-pyridyl]-3-[4-(1-piperidyl)butyl]urea CAS Name: formic acid; 1-[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]-3-[4-(1-piperidinyl)butyl]urea IUPAC Name: formic acid; 1-[6-(6-methoxypyridin-3-yl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl)urea Traditional Name: formic acid; 1-[6-(6-methoxy-3-pyridyl)-3-pyridyl]-3-(4-piperidinobutyl)urea Formula: C22H31N5O4 MolecularWeight: 429.51264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C2=NC=C(C=C2)NC(=O)NCCCCN3CCCCC3.C(=O)O

Isomeric SMILES

COC1=NC=C(C=C1)C2=NC=C(C=C2)NC(=O)NCCCCN3CCCCC3.C(=O)O

InChI

InChI=1S/C21H29N5O2.CH2O2/c1-28-20-10-7-17(15-24-20)19-9-8-18(16-23-19)25-21(27)22-11-3-6-14-26-12-4-2-5-13-26;2-1-3/h7-10,15-16H,2-6,11-14H2,1H3,(H2,22,25,27);1H,(H,2,3)