N-[6-cyano-9-(diethylamino)-5-oxidanylidene-benzo[a]phenothiazin-1-yl]benzenesulfonamide

Systemtic Name: N-[6-cyano-9-(diethylamino)-5-oxidanylidene-benzo[a]phenothiazin-1-yl]benzenesulfonamide Openeye Name: N-[6-cyano-9-(diethylamino)-5-oxo-benzo[a]phenothiazin-1-yl]benzenesulfonamide CAS Name: N-[6-cyano-9-(diethylamino)-5-oxo-1-benzo[a]phenothiazinyl]benzenesulfonamide IUPAC Name: N-[6-cyano-9-(diethylamino)-5-oxobenzo[a]phenothiazin-1-yl]benzenesulfonamide Traditional Name: N-[6-cyano-9-(diethylamino)-5-keto-benzo[a]phenothiazin-1-yl]benzenesulfonamide Formula: C27H22N4O3S2 MolecularWeight: 514.61858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)N=C3C4=C(C=CC=C4NS(=O)(=O)C5=CC=CC=C5)C(=O)C(=C3S2)C#N

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)N=C3C4=C(C=CC=C4NS(=O)(=O)C5=CC=CC=C5)C(=O)C(=C3S2)C#N

InChI

InChI=1S/C27H22N4O3S2/c1-3-31(4-2)17-13-14-21-23(15-17)35-27-20(16-28)26(32)19-11-8-12-22(24(19)25(27)29-21)30-36(33,34)18-9-6-5-7-10-18/h5-15,30H,3-4H2,1-2H3