(4-methylpiperazin-4-ium-1-yl)-[(6S)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-[(6S)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[(6S)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-3-yl]methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-[(6S)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-[(6S)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[(6S)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-3-yl]methanone Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC=C2C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C15H22N2OS/c1-11-3-4-12-13(10-19-14(12)9-11)15(18)17-7-5-16(2)6-8-17/h10-11H,3-9H2,1-2H3/p+1/t11-/m0/s1