1-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)-3-(2-nitrophenyl)thiourea

Systemtic Name: 1-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)-3-(2-nitrophenyl)thiourea Openeye Name: 1-(4-methyl-2-morpholinosulfonyl-phenyl)-3-(2-nitrophenyl)thiourea CAS Name: 1-[4-methyl-2-(4-morpholinylsulfonyl)phenyl]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-(4-methyl-2-morpholin-4-ylsulfonylphenyl)-3-(2-nitrophenyl)thiourea Traditional Name: 1-(4-methyl-2-morpholinosulfonyl-phenyl)-3-(2-nitrophenyl)thiourea Formula: C18H20N4O5S2 MolecularWeight: 436.5052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H20N4O5S2/c1-13-6-7-15(17(12-13)29(25,26)21-8-10-27-11-9-21)20-18(28)19-14-4-2-3-5-16(14)22(23)24/h2-7,12H,8-11H2,1H3,(H2,19,20,28)