5-nitro-N-[2-(phenylmethylsulfanyl)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[2-(phenylmethylsulfanyl)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[2-(phenylmethylthio)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-5-nitro-benzothiophene-2-carboxamide Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O3S2/c21-18(19-8-9-24-12-13-4-2-1-3-5-13)17-11-14-10-15(20(22)23)6-7-16(14)25-17/h1-7,10-11H,8-9,12H2,(H,19,21)