N,N-bis(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N,N-bis(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N,N-bis(cyanomethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N,N-bis(cyanomethyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N,N-bis(cyanomethyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N,N-bis(cyanomethyl)-3-pyrrolidinosulfonyl-benzamide Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CC#N)CC#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C15H16N4O3S/c16-6-10-18(11-7-17)15(20)13-4-3-5-14(12-13)23(21,22)19-8-1-2-9-19/h3-5,12H,1-2,8-11H2