(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

InChI

InChI=1S/C16H15N3O3S/c1-9-11-8-12(23-15(11)19(2)18-9)16(21)22-13(14(17)20)10-6-4-3-5-7-10/h3-8,13H,1-2H3,(H2,17,20)