4-[2-[[2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[[2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[[2-[(4-bromobenzoyl)amino]-3-methyl-butanoyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[2-[[(4-bromophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[[2-[(4-bromobenzoyl)amino]-3-methylbutanoyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[[2-[(4-bromobenzoyl)amino]-3-methyl-butanoyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C20H20BrN5O3S MolecularWeight: 490.3735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)C(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN5O3S/c1-10(2)16(25-18(28)11-3-5-13(21)6-4-11)19(29)26-20-24-15(9-30-20)12-7-14(17(22)27)23-8-12/h3-10,16,23H,1-2H3,(H2,22,27)(H,25,28)(H,24,26,29)