1,3-dibutyl-10-(2-chloranylethanoyl)-5-ethyl-2-methyl-pyrrolo[2,3-c][1,5]benzodiazepin-4-one

Systemtic Name: 1,3-dibutyl-10-(2-chloranylethanoyl)-5-ethyl-2-methyl-pyrrolo[2,3-c][1,5]benzodiazepin-4-one Openeye Name: 1,3-dibutyl-10-(2-chloroacetyl)-5-ethyl-2-methyl-pyrrolo[2,3-c][1,5]benzodiazepin-4-one CAS Name: 1,3-dibutyl-10-(2-chloro-1-oxoethyl)-5-ethyl-2-methyl-4-pyrrolo[2,3-c][1,5]benzodiazepinone IUPAC Name: 1,3-dibutyl-10-(2-chloroacetyl)-5-ethyl-2-methylpyrrolo[2,3-c][1,5]benzodiazepin-4-one Traditional Name: 1,3-dibutyl-10-(2-chloroacetyl)-5-ethyl-2-methyl-pyrrolo[2,3-c][1,5]benzodiazepin-4-one Formula: C24H32ClN3O2 MolecularWeight: 429.98278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C2=C1N(C3=CC=CC=C3N(C2=O)CC)C(=O)CCl)CCCC)C

Isomeric SMILES

CCCCC1=C(N(C2=C1N(C3=CC=CC=C3N(C2=O)CC)C(=O)CCl)CCCC)C

InChI

InChI=1S/C24H32ClN3O2/c1-5-8-12-18-17(4)27(15-9-6-2)23-22(18)28(21(29)16-25)20-14-11-10-13-19(20)26(7-3)24(23)30/h10-11,13-14H,5-9,12,15-16H2,1-4H3