methyl 2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C15H14N4O3S2 MolecularWeight: 362.42666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=NC3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=NC3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C15H14N4O3S2/c1-8-12(13(21)22-2)24-15(16-8)19-11(20)7-23-14-17-9-5-3-4-6-10(9)18-14/h3-6H,7H2,1-2H3,(H,17,18)(H,16,19,20)