N-(1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C17H18N3O2S+ MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H17N3O2S/c21-16(19-17-18-13-5-1-2-6-15(13)23-17)14-8-7-12(22-14)11-20-9-3-4-10-20/h1-2,5-8H,3-4,9-11H2,(H,18,19,21)/p+1