4-(4-methylphenyl)sulfanyl-5-nitro-6-pyridin-3-yloxy-pyrimidine

Systemtic Name: 4-(4-methylphenyl)sulfanyl-5-nitro-6-pyridin-3-yloxy-pyrimidine Openeye Name: 5-nitro-4-(p-tolylsulfanyl)-6-(3-pyridyloxy)pyrimidine CAS Name: 4-[(4-methylphenyl)thio]-5-nitro-6-(3-pyridinyloxy)pyrimidine IUPAC Name: 4-(4-methylphenyl)sulfanyl-5-nitro-6-pyridin-3-yloxypyrimidine Traditional Name: 5-nitro-4-(p-tolylthio)-6-(3-pyridyloxy)pyrimidine Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CN=CC=C3

InChI

InChI=1S/C16H12N4O3S/c1-11-4-6-13(7-5-11)24-16-14(20(21)22)15(18-10-19-16)23-12-3-2-8-17-9-12/h2-10H,1H3