4-[4-[5-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]piperidin-1-yl]-N,N-dimethyl-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-[5-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]piperidin-1-yl]-N,N-dimethyl-4-oxidanylidene-butanamide Openeye Name: 4-[4-[5-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]-1-piperidyl]-N,N-dimethyl-4-oxo-butanamide CAS Name: 4-[4-[5-[[(2-chloroanilino)-oxomethyl]amino]-1-pyrazolyl]-1-piperidinyl]-N,N-dimethyl-4-oxobutanamide IUPAC Name: 4-[4-[5-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]piperidin-1-yl]-N,N-dimethyl-4-oxobutanamide Traditional Name: 4-[4-[5-[(2-chlorophenyl)carbamoylamino]pyrazol-1-yl]piperidino]-4-keto-N,N-dimethyl-butyramide Formula: C21H27ClN6O3 MolecularWeight: 446.93048

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(=O)CCC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H27ClN6O3/c1-26(2)19(29)7-8-20(30)27-13-10-15(11-14-27)28-18(9-12-23-28)25-21(31)24-17-6-4-3-5-16(17)22/h3-6,9,12,15H,7-8,10-11,13-14H2,1-2H3,(H2,24,25,31)