3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide

Systemtic Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Openeye Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[2-(2-pyridyl)ethyl]benzamide CAS Name: 3-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[2-(2-pyridinyl)ethyl]benzamide IUPAC Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Traditional Name: 3-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[2-(2-pyridyl)ethyl]benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C23H21N3O2S/c1-16-8-9-21-20(13-16)26-23(28-21)29-15-17-5-4-6-18(14-17)22(27)25-12-10-19-7-2-3-11-24-19/h2-9,11,13-14H,10,12,15H2,1H3,(H,25,27)