(5S)-5-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-5-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-methyl-N-(4-methyl-1-piperazin-4-iumyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C15H24N3OS+ MolecularWeight: 294.43556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C15H23N3OS/c1-11-3-4-13-12(9-11)10-14(20-13)15(19)16-18-7-5-17(2)6-8-18/h10-11H,3-9H2,1-2H3,(H,16,19)/p+1/t11-/m0/s1