ethyl 4-methyl-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C16H15N5O5S2 MolecularWeight: 421.4508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H15N5O5S2/c1-3-26-14(23)13-8(2)17-16(28-13)20-12(22)7-27-15-18-10-5-4-9(21(24)25)6-11(10)19-15/h4-6H,3,7H2,1-2H3,(H,18,19)(H,17,20,22)