N-[4-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[(2S)-2-(5-methyl-2-furyl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[[(2S)-2-(5-methyl-2-furanyl)-2-(4-morpholin-4-iumyl)ethyl]amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ium-4-ylethyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[(2S)-2-(5-methyl-2-furyl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C23H26N3O4S+ MolecularWeight: 440.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3)[NH+]4CCOCC4

InChI

InChI=1S/C23H25N3O4S/c1-16-4-9-20(30-16)19(26-10-12-29-13-11-26)15-24-22(27)17-5-7-18(8-6-17)25-23(28)21-3-2-14-31-21/h2-9,14,19H,10-13,15H2,1H3,(H,24,27)(H,25,28)/p+1/t19-/m0/s1