N-[4-[4-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]phenyl]butan-2-yl]ethanamide

Systemtic Name: N-[4-[4-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]phenyl]butan-2-yl]ethanamide Openeye Name: N-[3-[4-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]phenyl]-1-methyl-propyl]acetamide CAS Name: N-[4-[4-[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]phenyl]butan-2-yl]acetamide IUPAC Name: N-[4-[4-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]phenyl]butan-2-yl]acetamide Traditional Name: N-[3-[4-[2-(1,3-benzoxazol-2-ylthio)acetyl]phenyl]-1-methyl-propyl]acetamide Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3O2)NC(=O)C

Isomeric SMILES

CC(CCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3O2)NC(=O)C

InChI

InChI=1S/C21H22N2O3S/c1-14(22-15(2)24)7-8-16-9-11-17(12-10-16)19(25)13-27-21-23-18-5-3-4-6-20(18)26-21/h3-6,9-12,14H,7-8,13H2,1-2H3,(H,22,24)