N-[2-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[[4-(pyrrolidin-1-ium-1-ylmethyl)thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[oxo-[[4-(1-pyrrolidin-1-iumylmethyl)-2-thiazolyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[[4-(pyrrolidin-1-ium-1-ylmethyl)thiazol-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C20H21N4O2S2+ MolecularWeight: 413.53634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

InChI

InChI=1S/C20H20N4O2S2/c25-18(23-20-21-14(13-28-20)12-24-9-3-4-10-24)15-6-1-2-7-16(15)22-19(26)17-8-5-11-27-17/h1-2,5-8,11,13H,3-4,9-10,12H2,(H,22,26)(H,21,23,25)/p+1