3-methyl-2-(phenylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide

Systemtic Name: 3-methyl-2-(phenylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-3-methyl-2-(phenylcarbamoylamino)butanamide CAS Name: 2-[[anilino(oxo)methyl]amino]-3-methyl-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]butanamide IUPAC Name: 3-methyl-2-(phenylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-3-methyl-2-(phenylcarbamoylamino)butyramide Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O3/c1-4-14-23-21(29)25-18-12-10-17(11-13-18)24-20(28)19(15(2)3)27-22(30)26-16-8-6-5-7-9-16/h4-13,15,19H,1,14H2,2-3H3,(H,24,28)(H2,23,25,29)(H2,26,27,30)