[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopentyl-dimethyl-azanium

Systemtic Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopentyl-dimethyl-azanium Openeye Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-cyclopentyl-dimethyl-ammonium CAS Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-cyclopentyl-dimethylammonium IUPAC Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-cyclopentyl-dimethylazanium Traditional Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-cyclopentyl-dimethyl-ammonium Formula: C18H26N3OS+ MolecularWeight: 332.48354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(=O)NC1=C(C2=C(S1)CCCC2)C#N)C3CCCC3

Isomeric SMILES

C[N+](C)(CC(=O)NC1=C(C2=C(S1)CCCC2)C#N)C3CCCC3

InChI

InChI=1S/C18H25N3OS/c1-21(2,13-7-3-4-8-13)12-17(22)20-18-15(11-19)14-9-5-6-10-16(14)23-18/h13H,3-10,12H2,1-2H3/p+1