N-(4-aminocarbonylphenyl)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(4-aminocarbonylphenyl)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(4-carbamoylphenyl)benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(4-carbamoylphenyl)benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(4-carbamoylphenyl)benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(4-carbamoylphenyl)benzamide Formula: C22H17N3O2S2 MolecularWeight: 419.51928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H17N3O2S2/c23-20(26)15-9-11-17(12-10-15)24-21(27)16-7-5-14(6-8-16)13-28-22-25-18-3-1-2-4-19(18)29-22/h1-12H,13H2,(H2,23,26)(H,24,27)