N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-chloranyl-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-chloranyl-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-4-chloro-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-chloro-N-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-chloro-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-4-chloro-N-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C18H26ClN3O4S MolecularWeight: 415.93474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C18H26ClN3O4S/c1-18(2,3)20-16(23)12-21(4)17(24)13-7-8-14(19)15(11-13)27(25,26)22-9-5-6-10-22/h7-8,11H,5-6,9-10,12H2,1-4H3,(H,20,23)