3-(1H-indol-3-yl)-2-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]-N-(phenylmethyl)propanamide

Systemtic Name: 3-(1H-indol-3-yl)-2-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-(1H-indol-3-yl)-2-[[(E)-1-methyl-3-oxo-but-1-enyl]amino]propanamide CAS Name: 3-(1H-indol-3-yl)-2-[[(E)-4-oxopent-2-en-2-yl]amino]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(1H-indol-3-yl)-2-[[(E)-4-oxopent-2-en-2-yl]amino]propanamide Traditional Name: N-benzyl-3-(1H-indol-3-yl)-2-[[(E)-3-keto-1-methyl-but-1-enyl]amino]propionamide Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)NC(CC1=CNC2=CC=CC=C21)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C/C(=C\C(=O)C)/NC(CC1=CNC2=CC=CC=C21)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O2/c1-16(12-17(2)27)26-22(23(28)25-14-18-8-4-3-5-9-18)13-19-15-24-21-11-7-6-10-20(19)21/h3-12,15,22,24,26H,13-14H2,1-2H3,(H,25,28)/b16-12+