5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]isoxazole-3-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[3-(1,3-dithian-2-yl)phenyl]isoxazole-3-carboxamide Formula: C20H17ClN2O2S2 MolecularWeight: 416.94418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H17ClN2O2S2/c21-15-6-1-4-13(10-15)18-12-17(23-25-18)19(24)22-16-7-2-5-14(11-16)20-26-8-3-9-27-20/h1-2,4-7,10-12,20H,3,8-9H2,(H,22,24)