4-(4-methylphenyl)sulfanyl-6-naphthalen-1-yloxy-5-nitro-pyrimidine

Systemtic Name: 4-(4-methylphenyl)sulfanyl-6-naphthalen-1-yloxy-5-nitro-pyrimidine Openeye Name: 4-(1-naphthyloxy)-5-nitro-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-[(4-methylphenyl)thio]-6-(1-naphthalenyloxy)-5-nitropyrimidine IUPAC Name: 4-(4-methylphenyl)sulfanyl-6-naphthalen-1-yloxy-5-nitropyrimidine Traditional Name: 4-(1-naphthoxy)-5-nitro-6-(p-tolylthio)pyrimidine Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H15N3O3S/c1-14-9-11-16(12-10-14)28-21-19(24(25)26)20(22-13-23-21)27-18-8-4-6-15-5-2-3-7-17(15)18/h2-13H,1H3