N-(3-pyrrolidin-1-ylpropyl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-(3-pyrrolidin-1-ylpropyl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-(3-pyrrolidin-1-ylpropyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-[3-(1-pyrrolidinyl)propyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-(3-pyrrolidin-1-ylpropyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-(3-pyrrolidinopropyl)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1CCN(C1)CCCNC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H21N3O4S/c20-15(17-8-5-11-18-9-3-4-10-18)12-19-16(21)13-6-1-2-7-14(13)24(19,22)23/h1-2,6-7H,3-5,8-12H2,(H,17,20)