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

Systemtic Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)pyrazol-4-yl]benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[1-(2-morpholino-2-oxo-ethyl)-3-(m-tolyl)pyrazol-4-yl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-[2-(4-morpholinyl)-2-oxoethyl]-4-pyrazolyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-[3-(3-methylphenyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[1-(2-keto-2-morpholino-ethyl)-3-(m-tolyl)pyrazol-4-yl]benzimidazol-2-one Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CC(=O)N5CCOCC5)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CC(=O)N5CCOCC5)N(C1=O)CC

InChI

InChI=1S/C27H31N5O3/c1-4-31-23-10-9-20(16-24(23)32(5-2)27(31)34)22-17-30(18-25(33)29-11-13-35-14-12-29)28-26(22)21-8-6-7-19(3)15-21/h6-10,15-17H,4-5,11-14,18H2,1-3H3