N-[(Z)-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylideneamino]-2-(2-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(Z)-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylideneamino]-2-(2-fluorophenyl)sulfanyl-ethanamide Openeye Name: 2-(2-fluorophenyl)sulfanyl-N-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]acetamide CAS Name: N-[(Z)-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methylideneamino]-2-[(2-fluorophenyl)thio]acetamide IUPAC Name: N-[(Z)-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methylideneamino]-2-(2-fluorophenyl)sulfanylacetamide Traditional Name: 2-[(2-fluorophenyl)thio]-N-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]acetamide Formula: C18H22FN3OS MolecularWeight: 347.450183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=NNC(=O)CSC2=CC=CC=C2F

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=N\NC(=O)CSC2=CC=CC=C2F

InChI

InChI=1S/C18H22FN3OS/c1-12(2)22-13(3)9-15(14(22)4)10-20-21-18(23)11-24-17-8-6-5-7-16(17)19/h5-10,12H,11H2,1-4H3,(H,21,23)/b20-10-