5-chloranyl-3-methyl-N-(4-methyl-2-morpholin-4-yl-pentyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(4-methyl-2-morpholin-4-yl-pentyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-(4-methyl-2-morpholino-pentyl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[4-methyl-2-(4-morpholinyl)pentyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(4-methyl-2-morpholino-pentyl)pyrazole-4-carboxamide Formula: C22H31ClN4O2 MolecularWeight: 418.96014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC(CC(C)C)N2CCOCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC(CC(C)C)N2CCOCC2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H31ClN4O2/c1-16(2)13-19(26-9-11-29-12-10-26)14-24-22(28)20-17(3)25-27(21(20)23)15-18-7-5-4-6-8-18/h4-8,16,19H,9-15H2,1-3H3,(H,24,28)