1,3-diethyl-5-[3-(3-methylphenyl)-1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzimidazol-2-one

Systemtic Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[1-(2-morpholinoethyl)-3-(m-tolyl)pyrazol-4-yl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-[2-(4-morpholinyl)ethyl]-4-pyrazolyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[1-(2-morpholinoethyl)-3-(m-tolyl)pyrazol-4-yl]benzimidazol-2-one Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CCN5CCOCC5)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CCN5CCOCC5)N(C1=O)CC

InChI

InChI=1S/C27H33N5O2/c1-4-31-24-10-9-21(18-25(24)32(5-2)27(31)33)23-19-30(12-11-29-13-15-34-16-14-29)28-26(23)22-8-6-7-20(3)17-22/h6-10,17-19H,4-5,11-16H2,1-3H3