N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Openeye Name: N-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide CAS Name: N-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3-benzothiazol-6-yl]-2-thiophenecarboxamide IUPAC Name: N-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Traditional Name: N-[2-[(2-keto-2-pyrrolidino-ethyl)thio]-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Formula: C18H17N3O2S3 MolecularWeight: 403.54148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C18H17N3O2S3/c22-16(21-7-1-2-8-21)11-25-18-20-13-6-5-12(10-15(13)26-18)19-17(23)14-4-3-9-24-14/h3-6,9-10H,1-2,7-8,11H2,(H,19,23)