S-octyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carbothioate

Systemtic Name: S-octyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carbothioate Openeye Name: S-octyl 2-thiazol-4-ylbenzimidazole-1-carbothioate CAS Name: 2-(4-thiazolyl)-1-benzimidazolecarbothioic acid S-octyl ester IUPAC Name: S-octyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carbothioate Traditional Name: 2-thiazol-4-ylbenzimidazole-1-carbothioic acid S-octyl ester Formula: C19H23N3OS2 MolecularWeight: 373.53542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

Isomeric SMILES

CCCCCCCCSC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

InChI

InChI=1S/C19H23N3OS2/c1-2-3-4-5-6-9-12-25-19(23)22-17-11-8-7-10-15(17)21-18(22)16-13-24-14-20-16/h7-8,10-11,13-14H,2-6,9,12H2,1H3