(2-oxidanylideneazepan-3-yl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-oxoazepan-3-yl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (2-ketoazepan-3-yl) ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC3CCCCNC3=O)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC3CCCCNC3=O)C

InChI

InChI=1S/C14H17N3O3S/c1-8-9-7-11(21-13(9)17(2)16-8)14(19)20-10-5-3-4-6-15-12(10)18/h7,10H,3-6H2,1-2H3,(H,15,18)