2-[[(2-bromophenyl)carbamoyl-butyl-amino]methyl]-N-butyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(2-bromophenyl)carbamoyl-butyl-amino]methyl]-N-butyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2-bromophenyl)carbamoyl-butyl-amino]methyl]-N-butyl-thiazole-4-carboxamide CAS Name: 2-[[[(2-bromoanilino)-oxomethyl]-butylamino]methyl]-N-butyl-4-thiazolecarboxamide IUPAC Name: 2-[[(2-bromophenyl)carbamoyl-butylamino]methyl]-N-butyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2-bromophenyl)carbamoyl-butyl-amino]methyl]-N-butyl-thiazole-4-carboxamide Formula: C20H27BrN4O2S MolecularWeight: 467.42298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)C(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)C(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C20H27BrN4O2S/c1-3-5-11-22-19(26)17-14-28-18(23-17)13-25(12-6-4-2)20(27)24-16-10-8-7-9-15(16)21/h7-10,14H,3-6,11-13H2,1-2H3,(H,22,26)(H,24,27)