5-nitro-N-(phenylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(phenylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(phenylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-5-nitro-benzothiophene-2-carboxamide Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O3S/c19-16(17-10-11-4-2-1-3-5-11)15-9-12-8-13(18(20)21)6-7-14(12)22-15/h1-9H,10H2,(H,17,19)