3-(cyclohexylcarbamoylamino)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]propanamide

Systemtic Name: 3-(cyclohexylcarbamoylamino)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]propanamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-3-(cyclohexylcarbamoylamino)propanamide CAS Name: 3-[[(cyclohexylamino)-oxomethyl]amino]-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]propanamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-3-(cyclohexylcarbamoylamino)propanamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-3-(cyclohexylcarbamoylamino)propionamide Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H33N5O2/c33-25(16-17-28-27(34)30-24-14-8-3-9-15-24)29-18-23-20-32(19-21-10-4-1-5-11-21)31-26(23)22-12-6-2-7-13-22/h1-2,4-7,10-13,20,24H,3,8-9,14-19H2,(H,29,33)(H2,28,30,34)