1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Formula: C19H18N6O6S2 MolecularWeight: 490.51282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18N6O6S2/c1-30-17-11-16(22-18(23-17)31-2)24-33(28,29)15-8-6-12(7-9-15)20-19(32)21-13-4-3-5-14(10-13)25(26)27/h3-11H,1-2H3,(H2,20,21,32)(H,22,23,24)