2-[2-(3-methylbutylamino)-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[2-(3-methylbutylamino)-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[2-(isopentylamino)-2-oxo-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[2-(3-methylbutylamino)-2-oxoethoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[2-(3-methylbutylamino)-2-oxoethoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[2-(isoamylamino)-2-keto-ethoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O5S/c1-13(2)7-8-20-17(22)12-26-16-6-5-14(11-15(16)18(19)23)27(24,25)21-9-3-4-10-21/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H2,19,23)(H,20,22)