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

Systemtic Name: 11-[2-(dimethylamino)ethanoyl]-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one Openeye Name: 11-[2-(dimethylamino)acetyl]-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one CAS Name: 11-[2-(dimethylamino)-1-oxoethyl]-6-methyl-2-phenyl-5-pyrimido[4,5-b][1,5]benzodiazepinone IUPAC Name: 11-[2-(dimethylamino)acetyl]-6-methyl-2-phenylpyrimido[4,5-b][1,5]benzodiazepin-5-one Traditional Name: 11-[2-(dimethylamino)acetyl]-6-methyl-2-phenyl-pyrimido[4,5-b][1,5]benzodiazepin-5-one Formula: C22H21N5O2 MolecularWeight: 387.43444

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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)CN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O2/c1-25(2)14-19(28)27-18-12-8-7-11-17(18)26(3)22(29)16-13-23-20(24-21(16)27)15-9-5-4-6-10-15/h4-13H,14H2,1-3H3