N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1,3-benzothiazole-6-carboxamide Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C19H18N4OS2/c1-25-9-8-16(18-21-13-4-2-3-5-14(13)22-18)23-19(24)12-6-7-15-17(10-12)26-11-20-15/h2-7,10-11,16H,8-9H2,1H3,(H,21,22)(H,23,24)