N-aminocarbonyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propanamide

Systemtic Name: N-aminocarbonyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propanamide Openeye Name: N-carbamoyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propanamide CAS Name: N-carbamoyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propanamide IUPAC Name: N-carbamoyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propanamide Traditional Name: N-carbamoyl-3-[(4S)-4-ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]propionamide Formula: C13H20N3O2S+ MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CC[NH+]1CCC(=O)NC(=O)N)SC=C2

Isomeric SMILES

CC[C@H]1C2=C(CC[NH+]1CCC(=O)NC(=O)N)SC=C2

InChI

InChI=1S/C13H19N3O2S/c1-2-10-9-5-8-19-11(9)3-6-16(10)7-4-12(17)15-13(14)18/h5,8,10H,2-4,6-7H2,1H3,(H3,14,15,17,18)/p+1/t10-/m0/s1