3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-1-thiophen-2-ylsulfonyl-pyrazole

Systemtic Name: 3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-1-thiophen-2-ylsulfonyl-pyrazole Openeye Name: 3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-1-(2-thienylsulfonyl)pyrazole CAS Name: 3,5-dimethyl-4-[(4-nitrophenyl)thio]-1-thiophen-2-ylsulfonylpyrazole IUPAC Name: 3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-1-thiophen-2-ylsulfonylpyrazole Traditional Name: 3,5-dimethyl-4-[(4-nitrophenyl)thio]-1-(2-thienylsulfonyl)pyrazole Formula: C15H13N3O4S3 MolecularWeight: 395.47642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=CS2)C)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=CS2)C)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O4S3/c1-10-15(24-13-7-5-12(6-8-13)18(19)20)11(2)17(16-10)25(21,22)14-4-3-9-23-14/h3-9H,1-2H3