5-methyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxo-ethyl]-5-methyl-thiophene-2-carboxamide CAS Name: 5-methyl-N-[2-oxo-2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide Traditional Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-keto-ethyl]-5-methyl-thiophene-2-carboxamide Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2S/c1-15-7-8-18(26-15)20(25)21-13-19(24)22-17-9-11-23(12-10-17)14-16-5-3-2-4-6-16/h2-8,17H,9-14H2,1H3,(H,21,25)(H,22,24)/p+1