ethyl 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C#N

InChI

InChI=1S/C18H24N4O4S/c1-4-25-17(24)22-7-5-21(6-8-22)16(23)20-15-13(10-19)12-9-18(2,3)26-11-14(12)27-15/h4-9,11H2,1-3H3,(H,20,23)