methyl 6-azanyl-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-4-[4-(benzimidazol-1-ylmethyl)-2-thienyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[4-(1-benzimidazolylmethyl)-2-thiophenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[4-(benzimidazol-1-ylmethyl)-2-thienyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid methyl ester Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N)C#N)C2=CC(=CS2)CN3C=NC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C#N)C2=CC(=CS2)CN3C=NC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H18N4O3S/c1-12-18(21(26)27-2)19(14(8-22)20(23)28-12)17-7-13(10-29-17)9-25-11-24-15-5-3-4-6-16(15)25/h3-7,10-11,19H,9,23H2,1-2H3