3-methyl-2-[3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium

Systemtic Name: 3-methyl-2-[3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Openeye Name: 3-methyl-2-[3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium CAS Name: 3-methyl-2-[3-(1,3,3-trimethyl-2-indolylidene)prop-1-enyl]-1,3-benzothiazol-3-ium IUPAC Name: 3-methyl-2-[3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Traditional Name: 3-methyl-2-[3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Formula: C22H23N2S+ MolecularWeight: 347.49642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=CC3=[N+](C4=CC=CC=C4S3)C)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC=CC3=[N+](C4=CC=CC=C4S3)C)C)C

InChI

InChI=1S/C22H23N2S/c1-22(2)16-10-5-6-11-17(16)23(3)20(22)14-9-15-21-24(4)18-12-7-8-13-19(18)25-21/h5-15H,1-4H3/q+1