N-[(Z)-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylideneamino]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[(Z)-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylideneamino]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[(Z)-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methylideneamino]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[(Z)-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methylideneamino]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-2-(8-quinolylthio)acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=NNC(=O)CSC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=N\NC(=O)CSC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-14(2)25-15(3)11-18(16(25)4)12-23-24-20(26)13-27-19-9-5-7-17-8-6-10-22-21(17)19/h5-12,14H,13H2,1-4H3,(H,24,26)/b23-12-