6-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-ethyl-5-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-ethyl-5-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-5-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-3-ethyl-5-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-5-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-5-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C20H21ClN4O2S/c1-3-23-12-22-18-16(19(23)26)13(2)17(28-18)20(27)25-9-7-24(8-10-25)15-6-4-5-14(21)11-15/h4-6,11-12H,3,7-10H2,1-2H3