3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[[4-(phenylcarbamoylamino)phenyl]amino]butan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[[4-(phenylcarbamoylamino)phenyl]amino]butan-2-yl]benzamide Openeye Name: 3-methyl-N-[(1S)-2-methyl-1-[[4-(phenylcarbamoylamino)phenyl]carbamoyl]propyl]benzamide CAS Name: N-[(2S)-1-[4-[[anilino(oxo)methyl]amino]anilino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-[4-(phenylcarbamoylamino)anilino]butan-2-yl]benzamide Traditional Name: 3-methyl-N-[(1S)-2-methyl-1-[[4-(phenylcarbamoylamino)phenyl]carbamoyl]propyl]benzamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C26H28N4O3/c1-17(2)23(30-24(31)19-9-7-8-18(3)16-19)25(32)27-21-12-14-22(15-13-21)29-26(33)28-20-10-5-4-6-11-20/h4-17,23H,1-3H3,(H,27,32)(H,30,31)(H2,28,29,33)/t23-/m0/s1