N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C21H24BrN3O4S/c1-14-5-7-17(30(28,29)25-9-3-4-10-25)12-18(14)21(27)23-13-20(26)24-19-8-6-16(22)11-15(19)2/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,23,27)(H,24,26)