1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitrophenyl)thiourea Formula: C18H16N6O5S2 MolecularWeight: 460.48684

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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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H16N6O5S2/c1-29-17-10-16(19-11-20-17)23-31(27,28)15-8-4-13(5-9-15)22-18(30)21-12-2-6-14(7-3-12)24(25)26/h2-11H,1H3,(H,19,20,23)(H2,21,22,30)