methyl (7S)-5-azanyl-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate

Systemtic Name: methyl (7S)-5-azanyl-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate Openeye Name: methyl (7S)-5-amino-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate CAS Name: (7S)-5-amino-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (7S)-5-amino-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate Traditional Name: (7S)-5-amino-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylic acid methyl ester Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C(C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(S1)[C@H](C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C18H14N2O5S/c1-8-13(18(21)22-2)15-16(26-8)14(10(6-19)17(20)25-15)9-3-4-11-12(5-9)24-7-23-11/h3-5,14H,7,20H2,1-2H3/t14-/m0/s1