3-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 1-benzyl-3-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]pyrimidine-2,4-dione CAS Name: 3-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 1-benzyl-3-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]pyrimidine-2,4-dione Traditional Name: 1-benzyl-3-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]pyrimidine-2,4-quinone Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)C=CN(C2=O)CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)C=CN(C2=O)CC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N4O4S/c27-19-8-9-25(15-17-5-2-1-3-6-17)22(30)26(19)16-20(28)23-10-12-24(13-11-23)21(29)18-7-4-14-31-18/h1-9,14H,10-13,15-16H2