6-azanyl-3,3-dimethyl-8-methylsulfanyl-1,4-dihydroisochromene-5,7-dicarbonitrile

Systemtic Name: 6-azanyl-3,3-dimethyl-8-methylsulfanyl-1,4-dihydroisochromene-5,7-dicarbonitrile Openeye Name: 6-amino-3,3-dimethyl-8-methylsulfanyl-isochromane-5,7-dicarbonitrile CAS Name: 6-amino-3,3-dimethyl-8-(methylthio)-3,4-dihydro-1H-2-benzopyran-5,7-dicarbonitrile IUPAC Name: 6-amino-3,3-dimethyl-8-methylsulfanyl-1,4-dihydroisochromene-5,7-dicarbonitrile Traditional Name: 6-amino-3,3-dimethyl-8-(methylthio)isochroman-5,7-dicarbonitrile Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=C(C(=C2CO1)SC)C#N)N)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=C(C(=C2CO1)SC)C#N)N)C#N)C

InChI

InChI=1S/C14H15N3OS/c1-14(2)4-8-9(5-15)12(17)10(6-16)13(19-3)11(8)7-18-14/h4,7,17H2,1-3H3