(8R,8aS)-6-azanyl-2-propyl-8-thiophen-3-yl-1,3,8,8a-tetrahydroisoquinoline-5,5,7-tricarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC=C2C(C1)C(C(=C(C2(C#N)C#N)N)C#N)C3=CSC=C3

Isomeric SMILES

CCCN1CC=C2[C@@H](C1)[C@H](C(=C(C2(C#N)C#N)N)C#N)C3=CSC=C3

InChI

InChI=1S/C19H19N5S/c1-2-5-24-6-3-16-15(9-24)17(13-4-7-25-10-13)14(8-20)18(23)19(16,11-21)12-22/h3-4,7,10,15,17H,2,5-6,9,23H2,1H3/t15-,17+/m1/s1