4-(4-chloranyl-3-methyl-phenoxy)-6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidine

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidine Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidine CAS Name: 4-(4-chloro-3-methylphenoxy)-6-[(4-chlorophenyl)thio]-5-nitropyrimidine IUPAC Name: 4-(4-chloro-3-methylphenoxy)-6-(4-chlorophenyl)sulfanyl-5-nitropyrimidine Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-6-[(4-chlorophenyl)thio]-5-nitro-pyrimidine Formula: C17H11Cl2N3O3S MolecularWeight: 408.25854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11Cl2N3O3S/c1-10-8-12(4-7-14(10)19)25-16-15(22(23)24)17(21-9-20-16)26-13-5-2-11(18)3-6-13/h2-9H,1H3