N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]octadecanamide

Systemtic Name: N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]octadecanamide Openeye Name: N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]octadecanamide CAS Name: N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]octadecanamide IUPAC Name: N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]octadecanamide Traditional Name: N-[4,4-bis(4-dimethylaminophenyl)-6-methyl-3,1-benzothiazin-2-yl]stearamide Formula: C43H62N4OS MolecularWeight: 683.04358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=NC2=C(C=C(C=C2)C)C(S1)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=NC2=C(C=C(C=C2)C)C(S1)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C43H62N4OS/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-41(48)45-42-44-40-32-23-34(2)33-39(40)43(49-42,35-24-28-37(29-25-35)46(3)4)36-26-30-38(31-27-36)47(5)6/h23-33H,7-22H2,1-6H3,(H,44,45,48)