ethyl 4-methyl-2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C15H15N3O2S3 MolecularWeight: 365.4935

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC3=C(S2)C=C(C=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC3=C(S2)C=C(C=C3)SC)C

InChI

InChI=1S/C15H15N3O2S3/c1-4-20-13(19)12-8(2)16-14(23-12)18-15-17-10-6-5-9(21-3)7-11(10)22-15/h5-7H,4H2,1-3H3,(H,16,17,18)