1-(2-chlorophenyl)-3-[2-[1-(2-ethylbutanoyl)piperidin-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(2-chlorophenyl)-3-[2-[1-(2-ethylbutanoyl)piperidin-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(2-chlorophenyl)-3-[2-[1-(2-ethylbutanoyl)-4-piperidyl]pyrazol-3-yl]urea CAS Name: 1-(2-chlorophenyl)-3-[2-[1-(2-ethyl-1-oxobutyl)-4-piperidinyl]-3-pyrazolyl]urea IUPAC Name: 1-(2-chlorophenyl)-3-[2-[1-(2-ethylbutanoyl)piperidin-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(2-chlorophenyl)-3-[2-[1-(2-ethylbutanoyl)-4-piperidyl]pyrazol-3-yl]urea Formula: C21H28ClN5O2 MolecularWeight: 417.93232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClN5O2/c1-3-15(4-2)20(28)26-13-10-16(11-14-26)27-19(9-12-23-27)25-21(29)24-18-8-6-5-7-17(18)22/h5-9,12,15-16H,3-4,10-11,13-14H2,1-2H3,(H2,24,25,29)