2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl-(phenylmethyl)amino]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl-(phenylmethyl)amino]-N-cyclohexyl-ethanamide Openeye Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-benzyl-amino]-N-cyclohexyl-acetamide CAS Name: 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-(phenylmethyl)amino]-N-cyclohexylacetamide IUPAC Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-benzylamino]-N-cyclohexylacetamide Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]-benzyl-amino]-N-cyclohexyl-acetamide Formula: C24H27N3O3S MolecularWeight: 437.55448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H27N3O3S/c28-22(25-19-11-5-2-6-12-19)16-27(15-18-9-3-1-4-10-18)23(29)17-31-24-26-20-13-7-8-14-21(20)30-24/h1,3-4,7-10,13-14,19H,2,5-6,11-12,15-17H2,(H,25,28)