6-tert-butyl-11-(2-morpholin-4-ylpropanoyl)-2-phenyl-pyrimido[5,4-c][1,5]benzodiazepin-5-one

Systemtic Name: 6-tert-butyl-11-(2-morpholin-4-ylpropanoyl)-2-phenyl-pyrimido[5,4-c][1,5]benzodiazepin-5-one Openeye Name: 6-tert-butyl-11-(2-morpholinopropanoyl)-2-phenyl-pyrimido[5,4-c][1,5]benzodiazepin-5-one CAS Name: 6-tert-butyl-11-[2-(4-morpholinyl)-1-oxopropyl]-2-phenyl-5-pyrimido[5,4-c][1,5]benzodiazepinone IUPAC Name: 6-tert-butyl-11-(2-morpholin-4-ylpropanoyl)-2-phenylpyrimido[5,4-c][1,5]benzodiazepin-5-one Traditional Name: 6-tert-butyl-11-(2-morpholinopropanoyl)-2-phenyl-pyrimido[5,4-c][1,5]benzodiazepin-5-one Formula: C28H31N5O3 MolecularWeight: 485.57744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2N(C(=O)C3=CN=C(N=C31)C4=CC=CC=C4)C(C)(C)C)N5CCOCC5

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2N(C(=O)C3=CN=C(N=C31)C4=CC=CC=C4)C(C)(C)C)N5CCOCC5

InChI

InChI=1S/C28H31N5O3/c1-19(31-14-16-36-17-15-31)26(34)32-22-12-8-9-13-23(22)33(28(2,3)4)27(35)21-18-29-24(30-25(21)32)20-10-6-5-7-11-20/h5-13,18-19H,14-17H2,1-4H3