N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoro-3-morpholinosulfonyl-benzamide CAS Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoro-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoro-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-fluoro-3-morpholinosulfonyl-benzamide Formula: C24H20BrFN4O4S MolecularWeight: 559.407403

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)N=C3C4=CC=CC=C4CN5C=C(C=CC5=N3)Br)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)N=C3C4=CC=CC=C4CN5C=C(C=CC5=N3)Br)F

InChI

InChI=1S/C24H20BrFN4O4S/c25-18-6-8-22-27-23(19-4-2-1-3-17(19)14-29(22)15-18)28-24(31)16-5-7-20(26)21(13-16)35(32,33)30-9-11-34-12-10-30/h1-8,13,15H,9-12,14H2