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

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[[4-(phenylcarbamoylamino)phenyl]amino]butan-2-yl]benzamide Openeye Name: 4-chloro-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]-4-chlorobenzamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[4-(phenylcarbamoylamino)anilino]butan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[[4-(phenylcarbamoylamino)phenyl]carbamoyl]propyl]benzamide Formula: C25H25ClN4O3 MolecularWeight: 464.944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H25ClN4O3/c1-16(2)22(30-23(31)17-8-10-18(26)11-9-17)24(32)27-20-12-14-21(15-13-20)29-25(33)28-19-6-4-3-5-7-19/h3-16,22H,1-2H3,(H,27,32)(H,30,31)(H2,28,29,33)/t22-/m0/s1