5,6-dimethyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(4-morpholino-4-oxo-butyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[4-(4-morpholinyl)-4-oxobutyl]thio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-(4-morpholin-4-yl-4-oxobutyl)sulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-4-morpholino-butyl)thio]-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)N3CCOCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)N3CCOCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H25N3O3S2/c1-15-16(2)30-20-19(15)21(27)25(17-7-4-3-5-8-17)22(23-20)29-14-6-9-18(26)24-10-12-28-13-11-24/h3-5,7-8H,6,9-14H2,1-2H3