methyl 2-[[2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-[(2-bromobenzoyl)amino]-3-methyl-butanoyl]amino]thiazole-5-carboxylate CAS Name: 2-[[2-[[(2-bromophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-bromobenzoyl)amino]-3-methylbutanoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(2-bromobenzoyl)amino]-3-methyl-butanoyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C17H18BrN3O4S MolecularWeight: 440.31152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC=C(S1)C(=O)OC)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)C(C(=O)NC1=NC=C(S1)C(=O)OC)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C17H18BrN3O4S/c1-9(2)13(20-14(22)10-6-4-5-7-11(10)18)15(23)21-17-19-8-12(26-17)16(24)25-3/h4-9,13H,1-3H3,(H,20,22)(H,19,21,23)