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

Systemtic Name: 4-(cyclohexylcarbamoylamino)-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Openeye Name: 4-(cyclohexylcarbamoylamino)-N-[(1-phenylpyrazol-4-yl)methyl]butanamide CAS Name: 4-[[(cyclohexylamino)-oxomethyl]amino]-N-[(1-phenyl-4-pyrazolyl)methyl]butanamide IUPAC Name: 4-(cyclohexylcarbamoylamino)-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Traditional Name: 4-(cyclohexylcarbamoylamino)-N-[(1-phenylpyrazol-4-yl)methyl]butyramide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H29N5O2/c27-20(12-7-13-22-21(28)25-18-8-3-1-4-9-18)23-14-17-15-24-26(16-17)19-10-5-2-6-11-19/h2,5-6,10-11,15-16,18H,1,3-4,7-9,12-14H2,(H,23,27)(H2,22,25,28)