N-(2-methylpropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-methylpropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-pyrrolidin-1-yl-benzamide Openeye Name: N-isobutyl-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-pyrrolidin-1-yl-benzamide CAS Name: N-(2-methylpropyl)-5-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-methylpropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-pyrrolidin-1-ylbenzamide Traditional Name: N-isobutyl-5-[[(E)-3-phenylacryloyl]amino]-2-pyrrolidino-benzamide Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C24H29N3O2/c1-18(2)17-25-24(29)21-16-20(11-12-22(21)27-14-6-7-15-27)26-23(28)13-10-19-8-4-3-5-9-19/h3-5,8-13,16,18H,6-7,14-15,17H2,1-2H3,(H,25,29)(H,26,28)/b13-10+