11-(2-chloranylethanoyl)-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one

Systemtic Name: 11-(2-chloranylethanoyl)-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one Openeye Name: 11-(2-chloroacetyl)-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one CAS Name: 11-(2-chloro-1-oxoethyl)-6-methyl-2-phenyl-5-pyrimido[4,5-b][1,5]benzodiazepinone IUPAC Name: 11-(2-chloroacetyl)-6-methyl-2-phenylpyrimido[4,5-b][1,5]benzodiazepin-5-one Traditional Name: 11-(2-chloroacetyl)-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one Formula: C20H15ClN4O2 MolecularWeight: 378.8117

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C3=NC(=NC=C3C1=O)C4=CC=CC=C4)C(=O)CCl

Isomeric SMILES

CN1C2=CC=CC=C2N(C3=NC(=NC=C3C1=O)C4=CC=CC=C4)C(=O)CCl

InChI

InChI=1S/C20H15ClN4O2/c1-24-15-9-5-6-10-16(15)25(17(26)11-21)19-14(20(24)27)12-22-18(23-19)13-7-3-2-4-8-13/h2-10,12H,11H2,1H3