1-(2-chloranyl-5-nitro-phenyl)-3-(pyridin-4-ylcarbonylamino)thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(pyridin-4-ylcarbonylamino)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(pyridine-4-carbonylamino)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[oxo(pyridin-4-yl)methyl]amino]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(pyridine-4-carbonylamino)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-isonicotinamido-thiourea Formula: C13H10ClN5O3S MolecularWeight: 351.7682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC(=S)NNC(=O)C2=CC=NC=C2)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC(=S)NNC(=O)C2=CC=NC=C2)Cl

InChI

InChI=1S/C13H10ClN5O3S/c14-10-2-1-9(19(21)22)7-11(10)16-13(23)18-17-12(20)8-3-5-15-6-4-8/h1-7H,(H,17,20)(H2,16,18,23)