N-(2-bromanyl-4-methyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H11BrN2O3S MolecularWeight: 391.23914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2O3S/c1-9-2-4-13(12(17)6-9)18-16(20)15-8-10-7-11(19(21)22)3-5-14(10)23-15/h2-8H,1H3,(H,18,20)