6-[(4-methylthiophen-2-yl)-piperazin-1-yl-methyl]isoquinoline

Systemtic Name: 6-[(4-methylthiophen-2-yl)-piperazin-1-yl-methyl]isoquinoline Openeye Name: 6-[(4-methyl-2-thienyl)-piperazin-1-yl-methyl]isoquinoline CAS Name: 6-[(4-methyl-2-thiophenyl)-(1-piperazinyl)methyl]isoquinoline IUPAC Name: 6-[(4-methylthiophen-2-yl)-piperazin-1-ylmethyl]isoquinoline Traditional Name: 6-[(4-methyl-2-thienyl)-piperazino-methyl]isoquinoline Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCNCC4

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCNCC4

InChI

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