3-ethyl-2-[3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]-3-phenyl-benzimidazol-2-ylidene]prop-1-enyl]-1,3-benzothiazol-3-ium

Systemtic Name: 3-ethyl-2-[3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]-3-phenyl-benzimidazol-2-ylidene]prop-1-enyl]-1,3-benzothiazol-3-ium Openeye Name: 3-ethyl-2-[3-[1-[(2-methylthiazol-4-yl)methyl]-3-phenyl-benzimidazol-2-ylidene]prop-1-enyl]-1,3-benzothiazol-3-ium CAS Name: 3-ethyl-2-[3-[1-[(2-methyl-4-thiazolyl)methyl]-3-phenyl-2-benzimidazolylidene]prop-1-enyl]-1,3-benzothiazol-3-ium IUPAC Name: 3-ethyl-2-[3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]-3-phenylbenzimidazol-2-ylidene]prop-1-enyl]-1,3-benzothiazol-3-ium Traditional Name: 3-ethyl-2-[3-[1-[(2-methylthiazol-4-yl)methyl]-3-phenyl-benzimidazol-2-ylidene]prop-1-enyl]-1,3-benzothiazol-3-ium Formula: C30H27N4S2+ MolecularWeight: 507.69218

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC=CC=C21)C=CC=C3N(C4=CC=CC=C4N3C5=CC=CC=C5)CC6=CSC(=N6)C

Isomeric SMILES

CC[N+]1=C(SC2=CC=CC=C21)C=CC=C3N(C4=CC=CC=C4N3C5=CC=CC=C5)CC6=CSC(=N6)C

InChI

InChI=1S/C30H27N4S2/c1-3-32-27-16-9-10-17-28(27)36-30(32)19-11-18-29-33(20-23-21-35-22(2)31-23)25-14-7-8-15-26(25)34(29)24-12-5-4-6-13-24/h4-19,21H,3,20H2,1-2H3/q+1