4-(cyclohexylcarbamoylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide

Systemtic Name: 4-(cyclohexylcarbamoylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide Openeye Name: 4-(cyclohexylcarbamoylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide CAS Name: 4-[[(cyclohexylamino)-oxomethyl]amino]-N-[2-(1-phenyl-4-pyrazolyl)ethyl]butanamide IUPAC Name: 4-(cyclohexylcarbamoylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide Traditional Name: 4-(cyclohexylcarbamoylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butyramide Formula: C22H31N5O2 MolecularWeight: 397.51384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCCC(=O)NCCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCCC(=O)NCCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H31N5O2/c28-21(12-7-14-24-22(29)26-19-8-3-1-4-9-19)23-15-13-18-16-25-27(17-18)20-10-5-2-6-11-20/h2,5-6,10-11,16-17,19H,1,3-4,7-9,12-15H2,(H,23,28)(H2,24,26,29)