1-(3-morpholin-4-ylsulfonylphenyl)-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-(3-morpholin-4-ylsulfonylphenyl)-3-(3-nitrophenyl)thiourea Openeye Name: 1-(3-morpholinosulfonylphenyl)-3-(3-nitrophenyl)thiourea CAS Name: 1-[3-(4-morpholinylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-(3-morpholin-4-ylsulfonylphenyl)-3-(3-nitrophenyl)thiourea Traditional Name: 1-(3-morpholinosulfonylphenyl)-3-(3-nitrophenyl)thiourea Formula: C17H18N4O5S2 MolecularWeight: 422.47862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S2/c22-21(23)15-5-1-3-13(11-15)18-17(27)19-14-4-2-6-16(12-14)28(24,25)20-7-9-26-10-8-20/h1-6,11-12H,7-10H2,(H2,18,19,27)