5-methoxy-3-methyl-4-(4-nitrophenyl)sulfanyl-1-phenyl-pyrazole

Systemtic Name: 5-methoxy-3-methyl-4-(4-nitrophenyl)sulfanyl-1-phenyl-pyrazole Openeye Name: 5-methoxy-3-methyl-4-(4-nitrophenyl)sulfanyl-1-phenyl-pyrazole CAS Name: 5-methoxy-3-methyl-4-[(4-nitrophenyl)thio]-1-phenylpyrazole IUPAC Name: 5-methoxy-3-methyl-4-(4-nitrophenyl)sulfanyl-1-phenylpyrazole Traditional Name: 5-methoxy-3-methyl-4-[(4-nitrophenyl)thio]-1-phenyl-pyrazole Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=C(C=C2)[N+](=O)[O-])OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=C(C=C2)[N+](=O)[O-])OC)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O3S/c1-12-16(24-15-10-8-14(9-11-15)20(21)22)17(23-2)19(18-12)13-6-4-3-5-7-13/h3-11H,1-2H3