N-[(4-bromanyl-2-nitro-phenyl)methyl]-4-prop-2-enoxy-2-pyridin-4-yl-2H-1,3-thiazole-3-carboxamide

Systemtic Name: N-[(4-bromanyl-2-nitro-phenyl)methyl]-4-prop-2-enoxy-2-pyridin-4-yl-2H-1,3-thiazole-3-carboxamide Openeye Name: 4-allyloxy-N-[(4-bromo-2-nitro-phenyl)methyl]-2-(4-pyridyl)-2H-thiazole-3-carboxamide CAS Name: N-[(4-bromo-2-nitrophenyl)methyl]-4-prop-2-enoxy-2-pyridin-4-yl-2H-thiazole-3-carboxamide IUPAC Name: N-[(4-bromo-2-nitrophenyl)methyl]-4-prop-2-enoxy-2-pyridin-4-yl-2H-1,3-thiazole-3-carboxamide Traditional Name: 4-allyloxy-N-(4-bromo-2-nitro-benzyl)-2-(4-pyridyl)-4-thiazoline-3-carboxamide Formula: C19H17BrN4O4S MolecularWeight: 477.33168

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CSC(N1C(=O)NCC2=C(C=C(C=C2)Br)[N+](=O)[O-])C3=CC=NC=C3

Isomeric SMILES

C=CCOC1=CSC(N1C(=O)NCC2=C(C=C(C=C2)Br)[N+](=O)[O-])C3=CC=NC=C3

InChI

InChI=1S/C19H17BrN4O4S/c1-2-9-28-17-12-29-18(13-5-7-21-8-6-13)23(17)19(25)22-11-14-3-4-15(20)10-16(14)24(26)27/h2-8,10,12,18H,1,9,11H2,(H,22,25)