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

Systemtic Name: 5-(furan-2-yl)-2-[(2-methylphenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5-(2-furyl)-2-(o-tolylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-furanyl)-2-[(2-methylphenyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(furan-2-yl)-2-[(2-methylphenyl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5-(2-furyl)-2-[(2-methylbenzyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C

InChI

InChI=1S/C21H18N2O2S2/c1-3-10-23-20(24)18-16(17-9-6-11-25-17)13-26-19(18)22-21(23)27-12-15-8-5-4-7-14(15)2/h3-9,11,13H,1,10,12H2,2H3