2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-pentyl-benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-pentyl-benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-pentyl-benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-pentylbenzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-pentylbenzamide Traditional Name: N-amyl-2-[(1,3-benzoxazol-2-ylthio)methyl]benzamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CCCCCNC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H22N2O2S/c1-2-3-8-13-21-19(23)16-10-5-4-9-15(16)14-25-20-22-17-11-6-7-12-18(17)24-20/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,21,23)