(2S)-1-[4-[4-[(5-bromanylthiophen-2-yl)carbonylamino]-2-oxidanylidene-pyrrolidin-1-yl]-2-methyl-phenyl]carbonyl-N-methyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[4-[4-[(5-bromanylthiophen-2-yl)carbonylamino]-2-oxidanylidene-pyrrolidin-1-yl]-2-methyl-phenyl]carbonyl-N-methyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[4-[4-[(5-bromothiophene-2-carbonyl)amino]-2-oxo-pyrrolidin-1-yl]-2-methyl-benzoyl]-N-methyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[4-[4-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-2-oxo-1-pyrrolidinyl]-2-methylphenyl]-oxomethyl]-N-methyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[4-[4-[(5-bromothiophene-2-carbonyl)amino]-2-oxopyrrolidin-1-yl]-2-methylbenzoyl]-N-methylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-[4-[4-[(5-bromothiophene-2-carbonyl)amino]-2-keto-pyrrolidino]-2-methyl-benzoyl]-N-methyl-pyrrolidine-2-carboxamide Formula: C23H25BrN4O4S MolecularWeight: 533.438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)NC(=O)C3=CC=C(S3)Br)C(=O)N4CCCC4C(=O)NC

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)NC(=O)C3=CC=C(S3)Br)C(=O)N4CCC[C@H]4C(=O)NC

InChI

InChI=1S/C23H25BrN4O4S/c1-13-10-15(5-6-16(13)23(32)27-9-3-4-17(27)21(30)25-2)28-12-14(11-20(28)29)26-22(31)18-7-8-19(24)33-18/h5-8,10,14,17H,3-4,9,11-12H2,1-2H3,(H,25,30)(H,26,31)/t14?,17-/m0/s1