2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H20N4OS2 MolecularWeight: 444.5718

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1CC(N(C1)CC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C24H20N4OS2/c29-22-16-13-20(15-7-2-1-3-8-15)31-23(16)27-21(26-22)14-28-12-6-10-18(28)24-25-17-9-4-5-11-19(17)30-24/h1-5,7-9,11,13,18H,6,10,12,14H2,(H,26,27,29)