N-[2-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]amino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]amino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-keto-2-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]amino]ethyl]thiophene-2-carboxamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O3S/c1-15-4-6-16(7-5-15)17(14-23-8-10-26-11-9-23)22-19(24)13-21-20(25)18-3-2-12-27-18/h2-7,12,17H,8-11,13-14H2,1H3,(H,21,25)(H,22,24)/p+1/t17-/m0/s1