N-phenyl-N-prop-2-enyl-2-[(4R)-4-thiophen-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]ethanamide

Systemtic Name: N-phenyl-N-prop-2-enyl-2-[(4R)-4-thiophen-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]ethanamide Openeye Name: N-allyl-N-phenyl-2-[(4R)-4-(2-thienyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]acetamide CAS Name: N-phenyl-N-prop-2-enyl-2-[(4R)-4-thiophen-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]acetamide IUPAC Name: N-phenyl-N-prop-2-enyl-2-[(4R)-4-thiophen-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]acetamide Traditional Name: N-allyl-N-phenyl-2-[(4R)-4-(2-thienyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]acetamide Formula: C22H23N2OS2+ MolecularWeight: 395.56082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC=C1)C(=O)C[NH+]2CCC3=C(C2C4=CC=CS4)C=CS3

Isomeric SMILES

C=CCN(C1=CC=CC=C1)C(=O)C[NH+]2CCC3=C([C@@H]2C4=CC=CS4)C=CS3

InChI

InChI=1S/C22H22N2OS2/c1-2-12-24(17-7-4-3-5-8-17)21(25)16-23-13-10-19-18(11-15-27-19)22(23)20-9-6-14-26-20/h2-9,11,14-15,22H,1,10,12-13,16H2/p+1/t22-/m1/s1