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

Systemtic Name: 5,6-dimethyl-2-[[(2-oxidanyl-3-prop-2-ynoxy-propyl)-prop-2-enyl-amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[allyl-(2-hydroxy-3-prop-2-ynoxy-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-prop-2-enylamino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-prop-2-enylamino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[allyl-(2-hydroxy-3-propargyloxy-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3S/c1-5-7-21(9-14(22)11-24-8-6-2)10-15-19-17(23)16-12(3)13(4)25-18(16)20-15/h2,5,14,22H,1,7-11H2,3-4H3,(H,19,20,23)