[2-(2,5-dimethylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methylazanium

Systemtic Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methylazanium Openeye Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5,6,7-tetrahydrobenzothiophen-3-yl]methylammonium CAS Name: [2-(2,5-dimethyl-1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methylammonium IUPAC Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methylazanium Traditional Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5,6,7-tetrahydrobenzothiophen-3-yl]methylammonium Formula: C15H21N2S+ MolecularWeight: 261.40564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C3=C(S2)CCCC3)C[NH3+])C

Isomeric SMILES

CC1=CC=C(N1C2=C(C3=C(S2)CCCC3)C[NH3+])C

InChI

InChI=1S/C15H20N2S/c1-10-7-8-11(2)17(10)15-13(9-16)12-5-3-4-6-14(12)18-15/h7-8H,3-6,9,16H2,1-2H3/p+1