N-(5-tert-butyl-2-methyl-phenyl)-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methyl-phenyl)-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(5-tert-butyl-2-methyl-phenyl)-7-nitro-benzothiophene-2-carboxamide CAS Name: N-(5-tert-butyl-2-methylphenyl)-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-tert-butyl-2-methylphenyl)-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(5-tert-butyl-2-methyl-phenyl)-7-nitro-benzothiophene-2-carboxamide Formula: C20H20N2O3S MolecularWeight: 368.4494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)NC(=O)C2=CC3=C(S2)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)NC(=O)C2=CC3=C(S2)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O3S/c1-12-8-9-14(20(2,3)4)11-15(12)21-19(23)17-10-13-6-5-7-16(22(24)25)18(13)26-17/h5-11H,1-4H3,(H,21,23)