phenyl N-(1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-yl)methanimidate

Systemtic Name: phenyl N-(1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-yl)methanimidate Openeye Name: phenyl N-(1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-yl)methanimidate CAS Name: N-(1,3-dimethyl-7-pyrido[2,1-b][1,3]benzothiazol-10-iumyl)methanimidic acid phenyl ester IUPAC Name: phenyl N-(1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-yl)methanimidate Traditional Name: N-(1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-yl)formimidic acid phenyl ester Formula: C20H17N2OS+ MolecularWeight: 333.42678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=C(C=C(C=C3)N=COC4=CC=CC=C4)SC2=C1)C

Isomeric SMILES

CC1=CC(=[N+]2C3=C(C=C(C=C3)N=COC4=CC=CC=C4)SC2=C1)C

InChI

InChI=1S/C20H17N2OS/c1-14-10-15(2)22-18-9-8-16(12-19(18)24-20(22)11-14)21-13-23-17-6-4-3-5-7-17/h3-13H,1-2H3/q+1