N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-4-methyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-4-methyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-4-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]ethyl]-4-methyl-3-pyrrol-1-yl-benzamide Formula: C20H17ClF3N3OS MolecularWeight: 439.88169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSC2=C(C=C(C=N2)C(F)(F)F)Cl)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSC2=C(C=C(C=N2)C(F)(F)F)Cl)N3C=CC=C3

InChI

InChI=1S/C20H17ClF3N3OS/c1-13-4-5-14(10-17(13)27-7-2-3-8-27)18(28)25-6-9-29-19-16(21)11-15(12-26-19)20(22,23)24/h2-5,7-8,10-12H,6,9H2,1H3,(H,25,28)