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

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-(5-nitropyridin-2-yl)thiourea Openeye Name: 1-(5-nitro-2-pyridyl)-3-(p-tolylmethyl)thiourea CAS Name: 1-[(4-methylphenyl)methyl]-3-(5-nitro-2-pyridinyl)thiourea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-(5-nitropyridin-2-yl)thiourea Traditional Name: 1-(4-methylbenzyl)-3-(5-nitro-2-pyridyl)thiourea Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N4O2S/c1-10-2-4-11(5-3-10)8-16-14(21)17-13-7-6-12(9-15-13)18(19)20/h2-7,9H,8H2,1H3,(H2,15,16,17,21)