N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide Openeye Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide CAS Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide IUPAC Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide Traditional Name: N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1,2,3,4-tetrahydroquinoline-8-sulfonamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NS(=O)(=O)C3=CC=CC4=C3NCCC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NS(=O)(=O)C3=CC=CC4=C3NCCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3S/c1-29-20-14-6-5-13-19(20)22(17-9-3-2-4-10-17)27-24(25(29)30)28-33(31,32)21-15-7-11-18-12-8-16-26-23(18)21/h2-7,9-11,13-15,24,26,28H,8,12,16H2,1H3