1-(4-methoxyphenyl)-3-[3-oxidanylidene-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]urea

Systemtic Name: 1-(4-methoxyphenyl)-3-[3-oxidanylidene-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]urea Openeye Name: 1-(4-methoxyphenyl)-3-[3-oxo-3-[4-(2-pyridylmethyl)piperazin-1-yl]propyl]urea CAS Name: 1-(4-methoxyphenyl)-3-[3-oxo-3-[4-(2-pyridinylmethyl)-1-piperazinyl]propyl]urea IUPAC Name: 1-(4-methoxyphenyl)-3-[3-oxo-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]urea Traditional Name: 1-[3-keto-3-[4-(2-pyridylmethyl)piperazino]propyl]-3-(4-methoxyphenyl)urea Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCCC(=O)N2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCCC(=O)N2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C21H27N5O3/c1-29-19-7-5-17(6-8-19)24-21(28)23-11-9-20(27)26-14-12-25(13-15-26)16-18-4-2-3-10-22-18/h2-8,10H,9,11-16H2,1H3,(H2,23,24,28)