(2R)-2-[[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]carbamoyl]pyrrolidine-1-carboxamide

Systemtic Name: (2R)-2-[[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]carbamoyl]pyrrolidine-1-carboxamide Openeye Name: (2R)-2-[[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]carbamoyl]pyrrolidine-1-carboxamide CAS Name: (2R)-2-[[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]hydrazo]-oxomethyl]-1-pyrrolidinecarboxamide IUPAC Name: (2R)-2-[[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]carbamoyl]pyrrolidine-1-carboxamide Traditional Name: (2R)-2-[[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]carbamoyl]pyrrolidine-1-carboxamide Formula: C15H17N5O3S2 MolecularWeight: 379.45718

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)N)C(=O)NNC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)N)C(=O)NNC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H17N5O3S2/c16-14(23)20-7-3-5-10(20)13(22)19-18-12(21)8-24-15-17-9-4-1-2-6-11(9)25-15/h1-2,4,6,10H,3,5,7-8H2,(H2,16,23)(H,18,21)(H,19,22)/t10-/m1/s1