N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-N-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27N3O4S/c1-16-8-6-9-17(2)21(16)23-20(26)15-24(3)22(27)18-10-7-11-19(14-18)30(28,29)25-12-4-5-13-25/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,26)