N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-benzyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-(phenylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-benzyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-benzyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-1,3-benzothiazole-6-carboxamide Formula: C23H17N3OS3 MolecularWeight: 447.59558

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C23H17N3OS3/c1-28-17-8-10-19-21(12-17)30-23(25-19)26(13-15-5-3-2-4-6-15)22(27)16-7-9-18-20(11-16)29-14-24-18/h2-12,14H,13H2,1H3