3-(3-methoxypropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-methoxypropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-methoxypropyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3-methoxypropyl)-2-[(5-methyl-3-isoxazolyl)methylthio]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3-methoxypropyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-methoxypropyl)-2-[(5-methylisoxazol-3-yl)methylthio]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2CCCOC

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2CCCOC

InChI

InChI=1S/C21H21N3O3S2/c1-14-11-16(23-27-14)13-28-21-22-19-17(20(25)24(21)9-6-10-26-2)12-18(29-19)15-7-4-3-5-8-15/h3-5,7-8,11-12H,6,9-10,13H2,1-2H3