N-[1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-pentan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-pentan-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[1-(1,3-benzothiazole-2-carbonyl)butyl]pyrrolidine-2-carboxamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)-1-oxopentan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)-1-oxopentan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[1-(1,3-benzothiazole-2-carbonyl)butyl]pyrrolidine-2-carboxamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2S1)NC(=O)C3CCCN3

Isomeric SMILES

CCCC(C(=O)C1=NC2=CC=CC=C2S1)NC(=O)C3CCCN3

InChI

InChI=1S/C17H21N3O2S/c1-2-6-12(19-16(22)13-8-5-10-18-13)15(21)17-20-11-7-3-4-9-14(11)23-17/h3-4,7,9,12-13,18H,2,5-6,8,10H2,1H3,(H,19,22)