N-butyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-butyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-butyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-butyl-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide IUPAC Name: N-butyl-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-butyl-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)CSC2=NC3=C(C=CC=C3O2)C

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)CSC2=NC3=C(C=CC=C3O2)C

InChI

InChI=1S/C20H22N2O2S/c1-3-4-11-21-19(23)16-9-6-8-15(12-16)13-25-20-22-18-14(2)7-5-10-17(18)24-20/h5-10,12H,3-4,11,13H2,1-2H3,(H,21,23)