1-(2,4-dimethylphenyl)-2,5-dimethyl-3-(2-nitrophenyl)sulfanyl-pyrrole

Systemtic Name: 1-(2,4-dimethylphenyl)-2,5-dimethyl-3-(2-nitrophenyl)sulfanyl-pyrrole Openeye Name: 1-(2,4-dimethylphenyl)-2,5-dimethyl-3-(2-nitrophenyl)sulfanyl-pyrrole CAS Name: 1-(2,4-dimethylphenyl)-2,5-dimethyl-3-[(2-nitrophenyl)thio]pyrrole IUPAC Name: 1-(2,4-dimethylphenyl)-2,5-dimethyl-3-(2-nitrophenyl)sulfanylpyrrole Traditional Name: 1-(2,4-dimethylphenyl)-2,5-dimethyl-3-[(2-nitrophenyl)thio]pyrrole Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=C2C)SC3=CC=CC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=C2C)SC3=CC=CC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C20H20N2O2S/c1-13-9-10-17(14(2)11-13)21-15(3)12-20(16(21)4)25-19-8-6-5-7-18(19)22(23)24/h5-12H,1-4H3