5-(3,4-dimethylphenyl)sulfanylisoquinolin-8-amine

Systemtic Name: 5-(3,4-dimethylphenyl)sulfanylisoquinolin-8-amine Openeye Name: 5-(3,4-dimethylphenyl)sulfanylisoquinolin-8-amine CAS Name: 5-[(3,4-dimethylphenyl)thio]-8-isoquinolinamine IUPAC Name: 5-(3,4-dimethylphenyl)sulfanylisoquinolin-8-amine Traditional Name: [5-[(3,4-dimethylphenyl)thio]-8-isoquinolyl]amine Formula: C17H16N2S MolecularWeight: 280.38734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C3C=CN=CC3=C(C=C2)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C3C=CN=CC3=C(C=C2)N)C

InChI

InChI=1S/C17H16N2S/c1-11-3-4-13(9-12(11)2)20-17-6-5-16(18)15-10-19-8-7-14(15)17/h3-10H,18H2,1-2H3