5-chloranyl-N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitro-benzamide Openeye Name: 5-chloro-2-nitro-N-[2-(p-tolyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide CAS Name: 5-chloro-N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide Traditional Name: 5-chloro-2-nitro-N-[2-(p-tolyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide Formula: C19H15ClN4O3S MolecularWeight: 414.8654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C3CSCC3=N2)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C3CSCC3=N2)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN4O3S/c1-11-2-5-13(6-3-11)23-18(15-9-28-10-16(15)22-23)21-19(25)14-8-12(20)4-7-17(14)24(26)27/h2-8H,9-10H2,1H3,(H,21,25)