ethyl (4S)-6-azanyl-4-(5-tert-butylthiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl (4S)-6-azanyl-4-(5-tert-butylthiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl (4S)-6-amino-4-(5-tert-butyl-2-thienyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-4-(5-tert-butyl-2-thiophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-amino-4-(5-tert-butylthiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-4-(5-tert-butyl-2-thienyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(S2)C(C)(C)C)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@H]1C2=CC=C(S2)C(C)(C)C)C#N)N)C

InChI

InChI=1S/C18H22N2O3S/c1-6-22-17(21)14-10(2)23-16(20)11(9-19)15(14)12-7-8-13(24-12)18(3,4)5/h7-8,15H,6,20H2,1-5H3/t15-/m1/s1