N-[2-nitro-4-(trifluoromethyl)phenyl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: 2-(1-allylbenzimidazol-2-yl)sulfanyl-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide CAS Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-allylbenzimidazol-2-yl)thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Formula: C19H15F3N4O3S MolecularWeight: 436.40761

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H15F3N4O3S/c1-2-9-25-15-6-4-3-5-13(15)24-18(25)30-11-17(27)23-14-8-7-12(19(20,21)22)10-16(14)26(28)29/h2-8,10H,1,9,11H2,(H,23,27)