N2,4,4-tris(4-dimethylaminophenyl)-N7,N7-diethyl-3,1-benzothiazine-2,7-diamine

Systemtic Name: N2,4,4-tris(4-dimethylaminophenyl)-N7,N7-diethyl-3,1-benzothiazine-2,7-diamine Openeye Name: N2,4,4-tris(4-dimethylaminophenyl)-N7,N7-diethyl-3,1-benzothiazine-2,7-diamine CAS Name: N2,4,4-tris(4-dimethylaminophenyl)-N7,N7-diethyl-3,1-benzothiazine-2,7-diamine IUPAC Name: 2-N,4,4-tris(4-dimethylaminophenyl)-7-N,7-N-diethyl-3,1-benzothiazine-2,7-diamine Traditional Name: [4-[[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]amino]phenyl]-dimethyl-amine Formula: C36H44N6S MolecularWeight: 592.83976

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NC3=CC=C(C=C3)N(C)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)NC3=CC=C(C=C3)N(C)C)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C36H44N6S/c1-9-42(10-2)32-23-24-33-34(25-32)38-35(37-28-15-21-31(22-16-28)41(7)8)43-36(33,26-11-17-29(18-12-26)39(3)4)27-13-19-30(20-14-27)40(5)6/h11-25H,9-10H2,1-8H3,(H,37,38)