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

Systemtic Name: 2-[(4-bromophenyl)amino]-4-methyl-N-[(4-nitrophenyl)methyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-bromoanilino)-4-methyl-N-[(4-nitrophenyl)methyl]thiazole-5-carboxamide CAS Name: 2-(4-bromoanilino)-4-methyl-N-[(4-nitrophenyl)methyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-bromoanilino)-4-methyl-N-[(4-nitrophenyl)methyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-bromoanilino)-4-methyl-N-(4-nitrobenzyl)thiazole-5-carboxamide Formula: C18H15BrN4O3S MolecularWeight: 447.3057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC=C(C=C2)Br)C(=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC=C(C=C2)Br)C(=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN4O3S/c1-11-16(27-18(21-11)22-14-6-4-13(19)5-7-14)17(24)20-10-12-2-8-15(9-3-12)23(25)26/h2-9H,10H2,1H3,(H,20,24)(H,21,22)