6-[piperazin-1-yl(thiophen-2-yl)methyl]isoquinoline

Systemtic Name: 6-[piperazin-1-yl(thiophen-2-yl)methyl]isoquinoline Openeye Name: 6-[piperazin-1-yl(2-thienyl)methyl]isoquinoline CAS Name: 6-[1-piperazinyl(thiophen-2-yl)methyl]isoquinoline IUPAC Name: 6-[piperazin-1-yl(thiophen-2-yl)methyl]isoquinoline Traditional Name: 6-[piperazino(2-thienyl)methyl]isoquinoline Formula: C18H19N3S MolecularWeight: 309.42856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CS4

InChI

InChI=1S/C18H19N3S/c1-2-17(22-11-1)18(21-9-7-19-8-10-21)15-3-4-16-13-20-6-5-14(16)12-15/h1-6,11-13,18-19H,7-10H2