1-(4-chloranyl-3-nitro-phenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-(4-chloro-3-nitrophenyl)-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(4-chloro-3-nitrophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C17H17ClN4O5S2 MolecularWeight: 456.92368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN4O5S2/c18-15-6-3-13(11-16(15)22(23)24)20-17(28)19-12-1-4-14(5-2-12)29(25,26)21-7-9-27-10-8-21/h1-6,11H,7-10H2,(H2,19,20,28)