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

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(3-pyridylmethyl)benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(3-pyridylmethyl)benzamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H17N3O2S/c25-20(23-13-15-6-5-11-22-12-15)17-8-2-1-7-16(17)14-27-21-24-18-9-3-4-10-19(18)26-21/h1-12H,13-14H2,(H,23,25)