2-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-keto-ethoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N

InChI

InChI=1S/C18H27N3O5S/c1-12(2)13(3)20-17(22)11-26-16-7-6-14(10-15(16)18(19)23)27(24,25)21-8-4-5-9-21/h6-7,10,12-13H,4-5,8-9,11H2,1-3H3,(H2,19,23)(H,20,22)/t13-/m0/s1