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

Systemtic Name: 2-[(E)-3-(1,3-dimethylbenzimidazol-2-ylidene)prop-1-enyl]-3-methyl-1,3-benzothiazol-3-ium Openeye Name: 2-[(E)-3-(1,3-dimethylbenzimidazol-2-ylidene)prop-1-enyl]-3-methyl-1,3-benzothiazol-3-ium CAS Name: 2-[(E)-3-(1,3-dimethyl-2-benzimidazolylidene)prop-1-enyl]-3-methyl-1,3-benzothiazol-3-ium IUPAC Name: 2-[(E)-3-(1,3-dimethylbenzimidazol-2-ylidene)prop-1-enyl]-3-methyl-1,3-benzothiazol-3-ium Traditional Name: 2-[(E)-3-(1,3-dimethylbenzimidazol-2-ylidene)prop-1-enyl]-3-methyl-1,3-benzothiazol-3-ium Formula: C20H20N3S+ MolecularWeight: 334.4579

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=CC=CC3=[N+](C4=CC=CC=C4S3)C)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C/C=C/C3=[N+](C4=CC=CC=C4S3)C)C

InChI

InChI=1S/C20H20N3S/c1-21-15-9-4-5-10-16(15)22(2)19(21)13-8-14-20-23(3)17-11-6-7-12-18(17)24-20/h4-14H,1-3H3/q+1