N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-4-methyl-benzenesulfonamide Formula: C35H41N5O2S2 MolecularWeight: 627.86234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NS(=O)(=O)C3=CC=C(C=C3)C)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NS(=O)(=O)C3=CC=C(C=C3)C)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C35H41N5O2S2/c1-8-40(9-2)30-20-23-32-33(24-30)36-34(37-44(41,42)31-21-10-25(3)11-22-31)43-35(32,26-12-16-28(17-13-26)38(4)5)27-14-18-29(19-15-27)39(6)7/h10-24H,8-9H2,1-7H3,(H,36,37)