5,6-dimethyl-3-prop-2-enyl-2-(quinolin-2-ylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-prop-2-enyl-2-(quinolin-2-ylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5,6-dimethyl-2-(2-quinolylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-prop-2-enyl-2-(2-quinolinylmethylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-prop-2-enyl-2-(quinolin-2-ylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5,6-dimethyl-2-(2-quinolylmethylthio)thieno[2,3-d]pyrimidin-4-one Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4C=C3)CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4C=C3)CC=C)C

InChI

InChI=1S/C21H19N3OS2/c1-4-11-24-20(25)18-13(2)14(3)27-19(18)23-21(24)26-12-16-10-9-15-7-5-6-8-17(15)22-16/h4-10H,1,11-12H2,2-3H3