5,6-dimethyl-2-[[(2-oxidanyl-3-prop-2-ynoxy-propyl)-propan-2-yl-amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[[(2-oxidanyl-3-prop-2-ynoxy-propyl)-propan-2-yl-amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(2-hydroxy-3-prop-2-ynoxy-propyl)-isopropyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-propan-2-ylamino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-propan-2-ylamino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-hydroxy-3-propargyloxy-propyl)-isopropyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC#C)O)C(C)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC#C)O)C(C)C)C

InChI

InChI=1S/C18H25N3O3S/c1-6-7-24-10-14(22)8-21(11(2)3)9-15-19-17(23)16-12(4)13(5)25-18(16)20-15/h1,11,14,22H,7-10H2,2-5H3,(H,19,20,23)