N-(2-methoxy-5-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-(4-quinazolinylthio)propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-quinazolin-4-ylsulfanylpropanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-(quinazolin-4-ylthio)propionamide Formula: C18H16N4O4S MolecularWeight: 384.40904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H16N4O4S/c1-11(27-18-13-5-3-4-6-14(13)19-10-20-18)17(23)21-15-9-12(22(24)25)7-8-16(15)26-2/h3-11H,1-2H3,(H,21,23)