(8aS)-5-azanyl-2-ethyl-6-(5-methylthiophen-2-yl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile

Systemtic Name: (8aS)-5-azanyl-2-ethyl-6-(5-methylthiophen-2-yl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile Openeye Name: (8aS)-5-amino-2-ethyl-6-(5-methyl-2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile CAS Name: (8aS)-5-amino-2-ethyl-6-(5-methyl-2-thiophenyl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile IUPAC Name: (8aS)-5-amino-2-ethyl-6-(5-methylthiophen-2-yl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile Traditional Name: (8aS)-5-amino-2-ethyl-6-(5-methyl-2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-7,7,8-tricarbonitrile Formula: C19H19N5S MolecularWeight: 349.45266

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC=C2C(C1)C(C(C(=C2N)C3=CC=C(S3)C)(C#N)C#N)C#N

Isomeric SMILES

CCN1CC=C2[C@@H](C1)C(C(C(=C2N)C3=CC=C(S3)C)(C#N)C#N)C#N

InChI

InChI=1S/C19H19N5S/c1-3-24-7-6-13-14(9-24)15(8-20)19(10-21,11-22)17(18(13)23)16-5-4-12(2)25-16/h4-6,14-15H,3,7,9,23H2,1-2H3/t14-,15?/m1/s1