2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H14N2O3S3 MolecularWeight: 414.52106

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

InChI

InChI=1S/C19H14N2O3S3/c22-17-16-12(15-6-3-7-25-15)10-26-18(16)21-19(20-17)27-9-11-8-23-13-4-1-2-5-14(13)24-11/h1-7,10-11H,8-9H2,(H,20,21,22)/t11-/m0/s1