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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H22N2O2S/c1-14(2)11-12-21-19(23)16-8-4-3-7-15(16)13-25-20-22-17-9-5-6-10-18(17)24-20/h3-10,14H,11-13H2,1-2H3,(H,21,23)