3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]propanamide CAS Name: 3-(1,3-benzoxazol-2-ylthio)-N-[4-(4-methoxyphenyl)-2-thiazolyl]propanamide IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-(1,3-benzoxazol-2-ylthio)-N-[4-(4-methoxyphenyl)thiazol-2-yl]propionamide Formula: C20H17N3O3S2 MolecularWeight: 411.49728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H17N3O3S2/c1-25-14-8-6-13(7-9-14)16-12-28-19(21-16)23-18(24)10-11-27-20-22-15-4-2-3-5-17(15)26-20/h2-9,12H,10-11H2,1H3,(H,21,23,24)