3-chloranyl-N-[3-[(2-methylphenyl)carbonylamino]phenyl]-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-[(2-methylphenyl)carbonylamino]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-[(2-methylbenzoyl)amino]phenyl]-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-[[(2-methylphenyl)-oxomethyl]amino]phenyl]-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-[(2-methylbenzoyl)amino]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-7-nitro-N-[3-(o-toluoylamino)phenyl]benzothiophene-2-carboxamide Formula: C23H16ClN3O4S MolecularWeight: 465.90884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC(=CC=C2)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC(=CC=C2)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H16ClN3O4S/c1-13-6-2-3-9-16(13)22(28)25-14-7-4-8-15(12-14)26-23(29)21-19(24)17-10-5-11-18(27(30)31)20(17)32-21/h2-12H,1H3,(H,25,28)(H,26,29)