1-(4-methylphenyl)-3-(5-nitropyridin-2-yl)thiourea

Systemtic Name: 1-(4-methylphenyl)-3-(5-nitropyridin-2-yl)thiourea Openeye Name: 1-(5-nitro-2-pyridyl)-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-(5-nitro-2-pyridinyl)thiourea IUPAC Name: 1-(4-methylphenyl)-3-(5-nitropyridin-2-yl)thiourea Traditional Name: 1-(5-nitro-2-pyridyl)-3-(p-tolyl)thiourea Formula: C13H12N4O2S MolecularWeight: 288.32498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O2S/c1-9-2-4-10(5-3-9)15-13(20)16-12-7-6-11(8-14-12)17(18)19/h2-8H,1H3,(H2,14,15,16,20)