3-methyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-(4-morpholino-4-oxo-butyl)sulfanyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[4-(4-morpholinyl)-4-oxobutyl]thio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-(4-morpholin-4-yl-4-oxobutyl)sulfanyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-4-morpholino-butyl)thio]-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCCC(=O)N3CCOCC3)SC=C2C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCCC(=O)N3CCOCC3)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-23-20(26)18-16(15-6-3-2-4-7-15)14-29-19(18)22-21(23)28-13-5-8-17(25)24-9-11-27-12-10-24/h2-4,6-7,14H,5,8-13H2,1H3