N-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-keto-3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propyl]thiophene-2-carboxamide Formula: C19H19F3N4O4S MolecularWeight: 456.43877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C19H19F3N4O4S/c20-19(21,22)13-3-4-14(15(12-13)26(29)30)24-7-9-25(10-8-24)17(27)5-6-23-18(28)16-2-1-11-31-16/h1-4,11-12H,5-10H2,(H,23,28)