N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-nitro-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-nitro-1H-pyrrole-2-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-nitro-1H-pyrrole-2-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-nitro-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-nitro-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4-nitro-1H-pyrrole-2-carboxamide Formula: C14H14FN3O3S MolecularWeight: 323.342663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC(=CN2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC(=CN2)[N+](=O)[O-])F

InChI

InChI=1S/C14H14FN3O3S/c15-12-4-2-1-3-10(12)9-22-6-5-16-14(19)13-7-11(8-17-13)18(20)21/h1-4,7-8,17H,5-6,9H2,(H,16,19)