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

Systemtic Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-2-phenoxy-acetamide CAS Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-2-phenoxyacetamide IUPAC Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-2-phenoxyacetamide Traditional Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]-2-phenoxy-acetamide Formula: C36H41N5O2S MolecularWeight: 607.80804

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NC(=O)COC3=CC=CC=C3)(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)NC(=O)COC3=CC=CC=C3)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C36H41N5O2S/c1-7-41(8-2)30-22-23-32-33(24-30)37-35(38-34(42)25-43-31-12-10-9-11-13-31)44-36(32,26-14-18-28(19-15-26)39(3)4)27-16-20-29(21-17-27)40(5)6/h9-24H,7-8,25H2,1-6H3,(H,37,38,42)