tert-butyl 4-[(5-cyanothiophen-2-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(5-cyanothiophen-2-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(5-cyano-2-thienyl)methyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[(5-cyano-2-thiophenyl)methyl]-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(5-cyanothiophen-2-yl)methyl]-3-oxopiperazine-1-carboxylate Traditional Name: 4-[(5-cyano-2-thienyl)methyl]-3-keto-piperazine-1-carboxylic acid tert-butyl ester Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CC2=CC=C(S2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CC2=CC=C(S2)C#N

InChI

InChI=1S/C15H19N3O3S/c1-15(2,3)21-14(20)18-7-6-17(13(19)10-18)9-12-5-4-11(8-16)22-12/h4-5H,6-7,9-10H2,1-3H3