(2S)-2-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]-N-propyl-propanamide Openeye Name: (2S)-2-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[(E)-3-(1,3-diphenyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[(E)-3-(1,3-diphenylpyrazol-4-yl)acryloyl]amino]-N-propyl-propionamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C=CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)/C=C/C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H26N4O2/c1-3-16-25-24(30)18(2)26-22(29)15-14-20-17-28(21-12-8-5-9-13-21)27-23(20)19-10-6-4-7-11-19/h4-15,17-18H,3,16H2,1-2H3,(H,25,30)(H,26,29)/b15-14+/t18-/m0/s1