(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C17H15NO4S3 MolecularWeight: 393.5003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C17H15NO4S3/c1-11-3-4-14(25(2,20)21)7-15(11)17(19)22-8-13-10-24-16(18-13)12-5-6-23-9-12/h3-7,9-10H,8H2,1-2H3