3-(2-azanylethylamino)-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 3-(2-azanylethylamino)-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 3-(2-aminoethylamino)-1-(2-furyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-(2-aminoethylamino)-1-(2-furanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 3-(2-aminoethylamino)-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 3-(2-aminoethylamino)-1-(2-furyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)NCCN)C3=CC=CO3

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)NCCN)C3=CC=CO3

InChI

InChI=1S/C16H18N4O/c17-7-8-19-16-13(10-18)11-4-1-2-5-12(11)15(20-16)14-6-3-9-21-14/h3,6,9H,1-2,4-5,7-8,17H2,(H,19,20)