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

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-pyridylmethyl)benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(2-pyridylmethyl)benzamide Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C21H17N3OS2/c25-20(23-13-17-5-3-4-12-22-17)16-10-8-15(9-11-16)14-26-21-24-18-6-1-2-7-19(18)27-21/h1-12H,13-14H2,(H,23,25)