3-[4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxo-butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[4-[4-(4-chlorophenyl)-1-piperazinyl]-4-oxobutyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[4-[4-(4-chlorophenyl)piperazino]-4-keto-butyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C20H21ClN4O3S/c21-14-3-5-15(6-4-14)23-9-11-24(12-10-23)17(26)2-1-8-25-19(27)18-16(7-13-29-18)22-20(25)28/h3-7,13H,1-2,8-12H2,(H,22,28)