3-(4-cyanophenyl)-1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)urea

Systemtic Name: 3-(4-cyanophenyl)-1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)urea Openeye Name: 3-(4-cyanophenyl)-1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholinopropyl)urea CAS Name: 3-(4-cyanophenyl)-1-[(1-methyl-2-pyrrolyl)methyl]-1-[3-(4-morpholinyl)propyl]urea IUPAC Name: 3-(4-cyanophenyl)-1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)urea Traditional Name: 3-(4-cyanophenyl)-1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholinopropyl)urea Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CCCN2CCOCC2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C=CC=C1CN(CCCN2CCOCC2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H27N5O2/c1-24-9-2-4-20(24)17-26(11-3-10-25-12-14-28-15-13-25)21(27)23-19-7-5-18(16-22)6-8-19/h2,4-9H,3,10-15,17H2,1H3,(H,23,27)