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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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