2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-thiophen-2-yl-prop-1-enyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium

Systemtic Name: 2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-thiophen-2-yl-prop-1-enyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium Openeye Name: 2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-(2-thienyl)prop-1-enyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium CAS Name: 2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-thiophen-2-ylprop-1-enyl]-1-methylbenzo[e][1,3]benzothiazol-1-ium IUPAC Name: 2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-thiophen-2-ylprop-1-enyl]-1-methylbenzo[e][1,3]benzothiazol-1-ium Traditional Name: 2-[3-(3-ethyl-6-methoxy-5-methyl-1,3-benzothiazol-2-ylidene)-2-(2-thienyl)prop-1-enyl]-1-methyl-benzo[e][1,3]benzothiazol-1-ium Formula: C30H27N2OS3+ MolecularWeight: 527.74318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C(=C2)C)OC)SC1=CC(=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)C)C6=CC=CS6

Isomeric SMILES

CCN1C2=C(C=C(C(=C2)C)OC)SC1=CC(=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)C)C6=CC=CS6

InChI

InChI=1S/C30H27N2OS3/c1-5-32-23-15-19(2)24(33-4)18-27(23)36-29(32)17-21(25-11-8-14-34-25)16-28-31(3)30-22-10-7-6-9-20(22)12-13-26(30)35-28/h6-18H,5H2,1-4H3/q+1