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

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-(pyridin-3-ylcarbonylamino)thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-(pyridine-3-carbonylamino)thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[[oxo(3-pyridinyl)methyl]amino]thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-(pyridine-3-carbonylamino)thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-nicotinamido-thiourea Formula: C14H13N5O4S MolecularWeight: 347.34912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)C2=CN=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H13N5O4S/c1-23-12-7-10(19(21)22)4-5-11(12)16-14(24)18-17-13(20)9-3-2-6-15-8-9/h2-8H,1H3,(H,17,20)(H2,16,18,24)