(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Openeye Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(8-quinolylmethyl)piperazin-1-yl]methanone CAS Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(8-quinolinylmethyl)-1-piperazinyl]methanone IUPAC Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Traditional Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(8-quinolylmethyl)piperazino]methanone Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C24H27N3OS/c1-17-7-8-21-20(14-17)15-22(29-21)24(28)27-12-10-26(11-13-27)16-19-5-2-4-18-6-3-9-25-23(18)19/h2-6,9,15,17H,7-8,10-14,16H2,1H3