N-(4-cyano-1-phenethyl-pyrazol-3-yl)-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide

Systemtic Name: N-(4-cyano-1-phenethyl-pyrazol-3-yl)-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide Openeye Name: N-(4-cyano-1-phenethyl-pyrazol-3-yl)-2-(cyclohexylmethyl)-4-morpholino-4-oxo-butanamide CAS Name: N-(4-cyano-1-phenethyl-3-pyrazolyl)-2-(cyclohexylmethyl)-4-(4-morpholinyl)-4-oxobutanamide IUPAC Name: N-(4-cyano-1-phenethylpyrazol-3-yl)-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxobutanamide Traditional Name: N-(4-cyano-1-phenethyl-pyrazol-3-yl)-2-(cyclohexylmethyl)-4-keto-4-morpholino-butyramide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC3=NN(C=C3C#N)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC3=NN(C=C3C#N)CCC4=CC=CC=C4

InChI

InChI=1S/C27H35N5O3/c28-19-24-20-32(12-11-21-7-3-1-4-8-21)30-26(24)29-27(34)23(17-22-9-5-2-6-10-22)18-25(33)31-13-15-35-16-14-31/h1,3-4,7-8,20,22-23H,2,5-6,9-18H2,(H,29,30,34)