N-[3-ethenyl-2-[(E)-2-iodanylprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]quinoline-7-carboxamide

Systemtic Name: N-[3-ethenyl-2-[(E)-2-iodanylprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]quinoline-7-carboxamide Openeye Name: N-[2-[(E)-2-iodoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]quinoline-7-carboxamide CAS Name: N-[3-ethenyl-2-[(E)-2-iodoprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]-7-quinolinecarboxamide IUPAC Name: N-[3-ethenyl-2-[(E)-2-iodoprop-1-enyl]-1H-2,4-benzodiazepin-5-ylidene]quinoline-7-carboxamide Traditional Name: N-[2-[(E)-2-iodoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]quinoline-7-carboxamide Formula: C24H19IN4O MolecularWeight: 506.33833

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CN1CC2=CC=CC=C2C(=NC(=O)C3=CC4=C(C=CC=N4)C=C3)N=C1C=C)I

Isomeric SMILES

C/C(=C\N1CC2=CC=CC=C2C(=NC(=O)C3=CC4=C(C=CC=N4)C=C3)N=C1C=C)/I

InChI

InChI=1S/C24H19IN4O/c1-3-22-27-23(20-9-5-4-7-19(20)15-29(22)14-16(2)25)28-24(30)18-11-10-17-8-6-12-26-21(17)13-18/h3-14H,1,15H2,2H3/b16-14+,28-23?