4,4-bis(4-dimethylaminophenyl)-N,N-diethyl-2-thiophen-3-yl-3,1-benzothiazin-7-amine

Systemtic Name: 4,4-bis(4-dimethylaminophenyl)-N,N-diethyl-2-thiophen-3-yl-3,1-benzothiazin-7-amine Openeye Name: 4,4-bis(4-dimethylaminophenyl)-N,N-diethyl-2-(3-thienyl)-3,1-benzothiazin-7-amine CAS Name: 4,4-bis(4-dimethylaminophenyl)-N,N-diethyl-2-(3-thiophenyl)-3,1-benzothiazin-7-amine IUPAC Name: 4,4-bis(4-dimethylaminophenyl)-N,N-diethyl-2-thiophen-3-yl-3,1-benzothiazin-7-amine Traditional Name: [4,4-bis(4-dimethylaminophenyl)-2-(3-thienyl)-3,1-benzothiazin-7-yl]-diethyl-amine Formula: C32H36N4S2 MolecularWeight: 540.78504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H36N4S2/c1-7-36(8-2)28-17-18-29-30(21-28)33-31(23-19-20-37-22-23)38-32(29,24-9-13-26(14-10-24)34(3)4)25-11-15-27(16-12-25)35(5)6/h9-22H,7-8H2,1-6H3