N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-2-pyrrolyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-(2-quinolylthio)acetamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3C=C2)CC4CCCO4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3C=C2)C[C@H]4CCCO4)C

InChI

InChI=1S/C23H24N4O2S/c1-15-16(2)27(13-18-7-5-11-29-18)23(19(15)12-24)26-21(28)14-30-22-10-9-17-6-3-4-8-20(17)25-22/h3-4,6,8-10,18H,5,7,11,13-14H2,1-2H3,(H,26,28)/t18-/m1/s1