1-(2-methoxy-4-nitro-phenyl)-3-(3-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-(3-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-(3-morpholinosulfonylphenyl)thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[3-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-(3-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-(3-morpholinosulfonylphenyl)thiourea Formula: C18H20N4O6S2 MolecularWeight: 452.5046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H20N4O6S2/c1-27-17-12-14(22(23)24)5-6-16(17)20-18(29)19-13-3-2-4-15(11-13)30(25,26)21-7-9-28-10-8-21/h2-6,11-12H,7-10H2,1H3,(H2,19,20,29)