5-cyclopropyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-cyclopropyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5-cyclopropyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-2-[(3-methyl-2-quinoxalinyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5-cyclopropyl-2-[(3-methylquinoxalin-2-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=C(C(=CS4)C5CC5)C(=O)N3CC=C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=C(C(=CS4)C5CC5)C(=O)N3CC=C

InChI

InChI=1S/C22H20N4OS2/c1-3-10-26-21(27)19-15(14-8-9-14)11-28-20(19)25-22(26)29-12-18-13(2)23-16-6-4-5-7-17(16)24-18/h3-7,11,14H,1,8-10,12H2,2H3