1-(4-bromanyl-2-chloranyl-phenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiourea Formula: C18H15BrClN5O3S2 MolecularWeight: 528.8304

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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=C(C=C(C=C3)Br)Cl

Isomeric SMILES

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H15BrClN5O3S2/c1-28-17-9-16(21-10-22-17)25-30(26,27)13-5-3-12(4-6-13)23-18(29)24-15-7-2-11(19)8-14(15)20/h2-10H,1H3,(H,21,22,25)(H2,23,24,29)