N-[4-[bis(fluoranyl)methoxy]phenyl]-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]phenyl]-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-[4-(difluoromethoxy)phenyl]-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-[4-(difluoromethoxy)phenyl]-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-[4-(difluoromethoxy)phenyl]-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-[4-(difluoromethoxy)phenyl]-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C18H18F2N4O3S MolecularWeight: 408.422326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C18H18F2N4O3S/c19-17(20)27-16-7-1-13(2-8-16)21-18(28)23-11-9-22(10-12-23)14-3-5-15(6-4-14)24(25)26/h1-8,17H,9-12H2,(H,21,28)