(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butyric acid (2-phenylthiazol-4-yl)methyl ester Formula: C21H21ClN2O4S2 MolecularWeight: 464.98544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CSC(=N1)C2=CC=CC=C2)NS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)OCC1=CSC(=N1)C2=CC=CC=C2)NS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O4S2/c1-14(2)19(24-30(26,27)18-10-6-9-16(22)11-18)21(25)28-12-17-13-29-20(23-17)15-7-4-3-5-8-15/h3-11,13-14,19,24H,12H2,1-2H3