6-[(5-methylthiophen-2-yl)-piperazin-1-yl-methyl]isoquinoline

Systemtic Name: 6-[(5-methylthiophen-2-yl)-piperazin-1-yl-methyl]isoquinoline Openeye Name: 6-[(5-methyl-2-thienyl)-piperazin-1-yl-methyl]isoquinoline CAS Name: 6-[(5-methyl-2-thiophenyl)-(1-piperazinyl)methyl]isoquinoline IUPAC Name: 6-[(5-methylthiophen-2-yl)-piperazin-1-ylmethyl]isoquinoline Traditional Name: 6-[(5-methyl-2-thienyl)-piperazino-methyl]isoquinoline Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCNCC4

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCNCC4

InChI

InChI=1S/C19H21N3S/c1-14-2-5-18(23-14)19(22-10-8-20-9-11-22)16-3-4-17-13-21-7-6-15(17)12-16/h2-7,12-13,19-20H,8-11H2,1H3