[2-[(5-methylsulfonyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 3-methylbutanoate

Systemtic Name: [2-[(5-methylsulfonyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 3-methylbutanoate Openeye Name: [2-[(5-methylsulfonylthiazol-2-yl)carbamoyl]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2-[[(5-methylsulfonyl-2-thiazolyl)amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[(5-methylsulfonyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [2-[(5-mesylthiazol-2-yl)carbamoyl]phenyl] ester Formula: C16H18N2O5S2 MolecularWeight: 382.45452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1=CC=CC=C1C(=O)NC2=NC=C(S2)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(=O)OC1=CC=CC=C1C(=O)NC2=NC=C(S2)S(=O)(=O)C

InChI

InChI=1S/C16H18N2O5S2/c1-10(2)8-13(19)23-12-7-5-4-6-11(12)15(20)18-16-17-9-14(24-16)25(3,21)22/h4-7,9-10H,8H2,1-3H3,(H,17,18,20)