ethyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-phenyl-propionic acid ethyl ester Formula: C16H20ClN3O4S MolecularWeight: 385.8657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C16H20ClN3O4S/c1-4-24-16(21)13(10-12-8-6-5-7-9-12)19-25(22,23)14-11(2)18-20(3)15(14)17/h5-9,13,19H,4,10H2,1-3H3