3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C20H21N3O3S/c24-17(13-23-19(25)18-16(8-11-27-18)21-20(23)26)22-9-6-15(7-10-22)12-14-4-2-1-3-5-14/h1-5,8,11,15H,6-7,9-10,12-13H2,(H,21,26)