ethyl (4S)-5-cyano-2-methyl-6-pyrrol-1-yl-4-thiophen-3-yl-4H-pyran-3-carboxylate

Systemtic Name: ethyl (4S)-5-cyano-2-methyl-6-pyrrol-1-yl-4-thiophen-3-yl-4H-pyran-3-carboxylate Openeye Name: ethyl (4S)-5-cyano-2-methyl-6-pyrrol-1-yl-4-(3-thienyl)-4H-pyran-3-carboxylate CAS Name: (4S)-5-cyano-2-methyl-6-(1-pyrrolyl)-4-(3-thiophenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-5-cyano-2-methyl-6-pyrrol-1-yl-4-thiophen-3-yl-4H-pyran-3-carboxylate Traditional Name: (4S)-5-cyano-2-methyl-6-pyrrol-1-yl-4-(3-thienyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CSC=C2)C#N)N3C=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@H]1C2=CSC=C2)C#N)N3C=CC=C3)C

InChI

InChI=1S/C18H16N2O3S/c1-3-22-18(21)15-12(2)23-17(20-7-4-5-8-20)14(10-19)16(15)13-6-9-24-11-13/h4-9,11,16H,3H2,1-2H3/t16-/m0/s1