2-[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H29N5O2/c1-24(2)21(28)16-25-11-6-12-26(14-13-25)22(29)20-15-19(17-9-10-17)23-27(20)18-7-4-3-5-8-18/h3-5,7-8,15,17H,6,9-14,16H2,1-2H3