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

Systemtic Name: 5,6-dimethyl-2-[[3-methylbutyl-(2-oxidanyl-3-prop-2-ynoxy-propyl)amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(2-hydroxy-3-prop-2-ynoxy-propyl)-isopentyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-(3-methylbutyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(2-hydroxy-3-prop-2-ynoxypropyl)-(3-methylbutyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-hydroxy-3-propargyloxy-propyl)-isoamyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O3S/c1-6-9-26-12-16(24)10-23(8-7-13(2)3)11-17-21-19(25)18-14(4)15(5)27-20(18)22-17/h1,13,16,24H,7-12H2,2-5H3,(H,21,22,25)