(E)-2-cyano-N-[3-ethenyl-2-[(E)-2-iodanylprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[3-ethenyl-2-[(E)-2-iodanylprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]-3-phenyl-prop-2-enamide Openeye Name: (E)-2-cyano-N-[2-[(E)-2-iodoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]-3-phenyl-prop-2-enamide CAS Name: (E)-2-cyano-N-[3-ethenyl-2-[(E)-2-iodoprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]-3-phenyl-2-propenamide IUPAC Name: (E)-2-cyano-N-[3-ethenyl-2-[(E)-2-iodoprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]-3-phenylprop-2-enamide Traditional Name: (E)-2-cyano-N-[2-[(E)-2-iodoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]-3-phenyl-acrylamide Formula: C24H19IN4O MolecularWeight: 506.33833

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CN1CC2=CC=CC=C2C(=NC(=O)C(=CC3=CC=CC=C3)C#N)N=C1C=C)I

Isomeric SMILES

C/C(=C\N1CC2=CC=CC=C2C(=NC(=O)/C(=C/C3=CC=CC=C3)/C#N)N=C1C=C)/I

InChI

InChI=1S/C24H19IN4O/c1-3-22-27-23(21-12-8-7-11-19(21)16-29(22)15-17(2)25)28-24(30)20(14-26)13-18-9-5-4-6-10-18/h3-13,15H,1,16H2,2H3/b17-15+,20-13+,28-23?