N-(4-bromophenyl)-4-methyl-2-[(4-nitrophenyl)carbonylamino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(4-bromophenyl)-4-methyl-2-[(4-nitrophenyl)carbonylamino]-1,3-thiazole-5-carboxamide Openeye Name: N-(4-bromophenyl)-4-methyl-2-[(4-nitrobenzoyl)amino]thiazole-5-carboxamide CAS Name: N-(4-bromophenyl)-4-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-5-thiazolecarboxamide IUPAC Name: N-(4-bromophenyl)-4-methyl-2-[(4-nitrobenzoyl)amino]-1,3-thiazole-5-carboxamide Traditional Name: N-(4-bromophenyl)-4-methyl-2-[(4-nitrobenzoyl)amino]thiazole-5-carboxamide Formula: C18H13BrN4O4S MolecularWeight: 461.28922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H13BrN4O4S/c1-10-15(17(25)21-13-6-4-12(19)5-7-13)28-18(20-10)22-16(24)11-2-8-14(9-3-11)23(26)27/h2-9H,1H3,(H,21,25)(H,20,22,24)