2-azanyl-4-[4-[(1-methylimidazol-2-yl)sulfanylmethyl]thiophen-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-[(1-methylimidazol-2-yl)sulfanylmethyl]thiophen-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-[4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-thienyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-[4-[[(1-methyl-2-imidazolyl)thio]methyl]-2-thiophenyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-[(1-methylimidazol-2-yl)sulfanylmethyl]thiophen-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-5-keto-4-[4-[[(1-methylimidazol-2-yl)thio]methyl]-2-thienyl]-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CSC(=C2)C3C(=C(OC4=C3C(=O)CCC4)N)C#N

Isomeric SMILES

CN1C=CN=C1SCC2=CSC(=C2)C3C(=C(OC4=C3C(=O)CCC4)N)C#N

InChI

InChI=1S/C19H18N4O2S2/c1-23-6-5-22-19(23)27-10-11-7-15(26-9-11)16-12(8-20)18(21)25-14-4-2-3-13(24)17(14)16/h5-7,9,16H,2-4,10,21H2,1H3