N-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-3,6-dimethyl-1,3-benzothiazol-2-imine

Systemtic Name: N-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-3,6-dimethyl-1,3-benzothiazol-2-imine Openeye Name: N-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-3,6-dimethyl-1,3-benzothiazol-2-imine CAS Name: N-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-3,6-dimethyl-1,3-benzothiazol-2-imine IUPAC Name: N-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-3,6-dimethyl-1,3-benzothiazol-2-imine Traditional Name: (Z)-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)amine Formula: C18H18N3S2+ MolecularWeight: 340.48562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC3=[N+](C4=C(S3)C=C(C=C4)C)C)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(/C(=N/C3=[N+](C4=C(S3)C=C(C=C4)C)C)/S2)C

InChI

InChI=1S/C18H18N3S2/c1-11-5-7-13-15(9-11)22-17(20(13)3)19-18-21(4)14-8-6-12(2)10-16(14)23-18/h5-10H,1-4H3/q+1