2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[(4-allyloxyphenyl)methyl-methyl-amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(4-allyloxybenzyl)-methyl-amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)CC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)CC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C18H19N3O2S/c1-3-9-23-14-6-4-13(5-7-14)11-21(2)12-16-19-15-8-10-24-17(15)18(22)20-16/h3-8,10H,1,9,11-12H2,2H3,(H,19,20,22)