N-[(4-methylphenyl)methyl]-5-(phenylmethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-5-(phenylmethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide Openeye Name: 5-benzyl-N-(p-tolylmethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-5-(phenylmethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide IUPAC Name: 5-benzyl-N-[(4-methylphenyl)methyl]-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide Traditional Name: 5-benzyl-N-(4-methylbenzyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-5-ium-2-carboxamide Formula: C22H23N2OS+ MolecularWeight: 363.49582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(S2)C[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(S2)C[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N2OS/c1-16-7-9-17(10-8-16)12-23-22(25)20-11-19-14-24(15-21(19)26-20)13-18-5-3-2-4-6-18/h2-11H,12-15H2,1H3,(H,23,25)/p+1