2-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)N

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)N

InChI

InChI=1S/C19H24N4O5S/c1-19(12-20,13-4-5-13)22-17(24)11-28-16-7-6-14(10-15(16)18(21)25)29(26,27)23-8-2-3-9-23/h6-7,10,13H,2-5,8-9,11H2,1H3,(H2,21,25)(H,22,24)/t19-/m0/s1