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

Systemtic Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-phenethyl-benzamide Openeye Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-phenethyl-benzamide CAS Name: 4-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-phenethylbenzamide IUPAC Name: 4-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-phenethylbenzamide Traditional Name: 4-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-phenethyl-benzamide Formula: C24H22N2O2S MolecularWeight: 402.50868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=C(C=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=C(C=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-17-7-12-22-21(15-17)26-24(28-22)29-16-19-8-10-20(11-9-19)23(27)25-14-13-18-5-3-2-4-6-18/h2-12,15H,13-14,16H2,1H3,(H,25,27)