3-[(4-methoxyphenyl)carbamoylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-[(4-methoxyphenyl)carbamoylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-[(4-methoxyphenyl)carbamoylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-[[(4-methoxyanilino)-oxomethyl]amino]-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-[(4-methoxyphenyl)carbamoylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-[(4-methoxyphenyl)carbamoylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-29-19-9-7-17(8-10-19)25-21(28)22-12-11-20(27)23-13-16-14-24-26(15-16)18-5-3-2-4-6-18/h2-10,14-15H,11-13H2,1H3,(H,23,27)(H2,22,25,28)