N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-pyrrolidinosulfonyl-benzamide Formula: C24H21IN4O3S MolecularWeight: 572.41801

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3C4=CC=CC=C4CN5C=C(C=CC5=N3)I

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3C4=CC=CC=C4CN5C=C(C=CC5=N3)I

InChI

InChI=1S/C24H21IN4O3S/c25-19-9-12-22-26-23(21-6-2-1-5-18(21)15-28(22)16-19)27-24(30)17-7-10-20(11-8-17)33(31,32)29-13-3-4-14-29/h1-2,5-12,16H,3-4,13-15H2