4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide

Systemtic Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Openeye Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[2-(2-pyridyl)ethyl]benzamide CAS Name: 4-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[2-(2-pyridinyl)ethyl]benzamide IUPAC Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Traditional Name: 4-[[(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=C(C=C3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

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

InChI

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