1-(2-methyl-6-nitro-phenyl)-3-pyridin-3-yl-thiourea

Systemtic Name: 1-(2-methyl-6-nitro-phenyl)-3-pyridin-3-yl-thiourea Openeye Name: 1-(2-methyl-6-nitro-phenyl)-3-(3-pyridyl)thiourea CAS Name: 1-(2-methyl-6-nitrophenyl)-3-(3-pyridinyl)thiourea IUPAC Name: 1-(2-methyl-6-nitrophenyl)-3-pyridin-3-ylthiourea Traditional Name: 1-(2-methyl-6-nitro-phenyl)-3-(3-pyridyl)thiourea Formula: C13H12N4O2S MolecularWeight: 288.32498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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