3,5-diacetamido-N-[4-(prop-2-enylcarbamoylamino)phenyl]benzamide

Systemtic Name: 3,5-diacetamido-N-[4-(prop-2-enylcarbamoylamino)phenyl]benzamide Openeye Name: 3,5-diacetamido-N-[4-(allylcarbamoylamino)phenyl]benzamide CAS Name: 3,5-diacetamido-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]benzamide IUPAC Name: 3,5-diacetamido-N-[4-(prop-2-enylcarbamoylamino)phenyl]benzamide Traditional Name: 3,5-diacetamido-N-[4-(allylcarbamoylamino)phenyl]benzamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)NCC=C)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)NCC=C)NC(=O)C

InChI

InChI=1S/C21H23N5O4/c1-4-9-22-21(30)26-17-7-5-16(6-8-17)25-20(29)15-10-18(23-13(2)27)12-19(11-15)24-14(3)28/h4-8,10-12H,1,9H2,2-3H3,(H,23,27)(H,24,28)(H,25,29)(H2,22,26,30)