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

Systemtic Name: (8aS)-8-azanyl-2-ethyl-5-thiophen-3-yl-1,3,5,8a-tetrahydroisoquinoline-6,6,7-tricarbonitrile Openeye Name: (8aS)-8-amino-2-ethyl-5-(3-thienyl)-1,3,5,8a-tetrahydroisoquinoline-6,6,7-tricarbonitrile CAS Name: (8aS)-8-amino-2-ethyl-5-(3-thiophenyl)-1,3,5,8a-tetrahydroisoquinoline-6,6,7-tricarbonitrile IUPAC Name: (8aS)-8-amino-2-ethyl-5-thiophen-3-yl-1,3,5,8a-tetrahydroisoquinoline-6,6,7-tricarbonitrile Traditional Name: (8aS)-8-amino-2-ethyl-5-(3-thienyl)-1,3,5,8a-tetrahydroisoquinoline-6,6,7-tricarbonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC=C2C(C1)C(=C(C(C2C3=CSC=C3)(C#N)C#N)C#N)N

Isomeric SMILES

CCN1CC=C2[C@@H](C1)C(=C(C(C2C3=CSC=C3)(C#N)C#N)C#N)N

InChI

InChI=1S/C18H17N5S/c1-2-23-5-3-13-14(8-23)17(22)15(7-19)18(10-20,11-21)16(13)12-4-6-24-9-12/h3-4,6,9,14,16H,2,5,8,22H2,1H3/t14-,16?/m1/s1