3-chloranyl-11-cyclopropyl-6-prop-2-enyl-pyridazino[3,4-b][1,5]benzodiazepin-5-one

Systemtic Name: 3-chloranyl-11-cyclopropyl-6-prop-2-enyl-pyridazino[3,4-b][1,5]benzodiazepin-5-one Openeye Name: 6-allyl-3-chloro-11-cyclopropyl-pyridazino[3,4-b][1,5]benzodiazepin-5-one CAS Name: 3-chloro-11-cyclopropyl-6-prop-2-enyl-5-pyridazino[3,4-b][1,5]benzodiazepinone IUPAC Name: 3-chloro-11-cyclopropyl-6-prop-2-enylpyridazino[3,4-b][1,5]benzodiazepin-5-one Traditional Name: 6-allyl-3-chloro-11-cyclopropyl-pyridazino[3,4-b][1,5]benzodiazepin-5-one Formula: C17H15ClN4O MolecularWeight: 326.7802

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N(C3=NN=C(C=C3C1=O)Cl)C4CC4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N(C3=NN=C(C=C3C1=O)Cl)C4CC4

InChI

InChI=1S/C17H15ClN4O/c1-2-9-21-13-5-3-4-6-14(13)22(11-7-8-11)16-12(17(21)23)10-15(18)19-20-16/h2-6,10-11H,1,7-9H2