(2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl-cyclohexyl-azanium

Systemtic Name: (2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl-cyclohexyl-azanium Openeye Name: (2-benzamido-4,5,6,7-tetrahydrobenzothiophen-3-yl)methyl-cyclohexyl-ammonium CAS Name: (2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl-cyclohexylammonium IUPAC Name: (2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl-cyclohexylazanium Traditional Name: (2-benzamido-4,5,6,7-tetrahydrobenzothiophen-3-yl)methyl-cyclohexyl-ammonium Formula: C22H29N2OS+ MolecularWeight: 369.54346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]CC2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)[NH2+]CC2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H28N2OS/c25-21(16-9-3-1-4-10-16)24-22-19(15-23-17-11-5-2-6-12-17)18-13-7-8-14-20(18)26-22/h1,3-4,9-10,17,23H,2,5-8,11-15H2,(H,24,25)/p+1