(2Z)-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-prop-2-enyl-1,3-benzothiazole

Systemtic Name: (2Z)-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-prop-2-enyl-1,3-benzothiazole Openeye Name: (2Z)-3-allyl-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylene]-1,3-benzothiazole CAS Name: (2Z)-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-prop-2-enyl-1,3-benzothiazole IUPAC Name: (2Z)-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-prop-2-enyl-1,3-benzothiazole Traditional Name: (2Z)-3-allyl-5-methyl-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylene]-1,3-benzothiazole Formula: C20H19N2S2+ MolecularWeight: 351.50826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=CC3=[N+](C4=CC=CC=C4S3)C)N2CC=C

Isomeric SMILES

CC1=CC2=C(C=C1)S/C(=C\C3=[N+](C4=CC=CC=C4S3)C)/N2CC=C

InChI

InChI=1S/C20H19N2S2/c1-4-11-22-16-12-14(2)9-10-18(16)24-20(22)13-19-21(3)15-7-5-6-8-17(15)23-19/h4-10,12-13H,1,11H2,2-3H3/q+1