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

Systemtic Name: 1-[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[4-[(6-chloro-3-pyridazinyl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Formula: C17H13ClN6O4S2 MolecularWeight: 464.90592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN6O4S2/c18-15-8-9-16(22-21-15)23-30(27,28)14-6-4-11(5-7-14)19-17(29)20-12-2-1-3-13(10-12)24(25)26/h1-10H,(H,22,23)(H2,19,20,29)