1-(2-methoxypyridin-3-yl)-3-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]urea

Systemtic Name: 1-(2-methoxypyridin-3-yl)-3-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]urea Openeye Name: 1-[3-(4-benzylpiperazin-1-yl)propyl]-3-(2-methoxy-3-pyridyl)urea CAS Name: 1-(2-methoxy-3-pyridinyl)-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]urea IUPAC Name: 1-[3-(4-benzylpiperazin-1-yl)propyl]-3-(2-methoxypyridin-3-yl)urea Traditional Name: 1-[3-(4-benzylpiperazino)propyl]-3-(2-methoxy-3-pyridyl)urea Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)NC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC=N1)NC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N5O2/c1-28-20-19(9-5-10-22-20)24-21(27)23-11-6-12-25-13-15-26(16-14-25)17-18-7-3-2-4-8-18/h2-5,7-10H,6,11-17H2,1H3,(H2,23,24,27)