2-[[(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[4-methyl-2-(3-thienyl)thiazole-5-carbonyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[[4-methyl-2-(3-thiophenyl)-5-thiazolyl]-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carbonyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[4-methyl-2-(3-thienyl)thiazole-5-carbonyl]amino]methyl]-4-nitro-phenolate Formula: C16H12N3O4S2- MolecularWeight: 374.41418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O4S2/c1-9-14(25-16(18-9)10-4-5-24-8-10)15(21)17-7-11-6-12(19(22)23)2-3-13(11)20/h2-6,8,20H,7H2,1H3,(H,17,21)/p-1