prop-2-enyl 5-methyl-2-[[2-oxidanylbutyl-(phenylmethyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl 5-methyl-2-[[2-oxidanylbutyl-(phenylmethyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[benzyl(2-hydroxybutyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-hydroxybutyl-(phenylmethyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[benzyl(2-hydroxybutyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[benzyl(2-hydroxybutyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CC1=CC=CC=C1)CC2=NC3=C(C(=C(S3)C(=O)OCC=C)C)C(=O)N2)O

Isomeric SMILES

CCC(CN(CC1=CC=CC=C1)CC2=NC3=C(C(=C(S3)C(=O)OCC=C)C)C(=O)N2)O

InChI

InChI=1S/C23H27N3O4S/c1-4-11-30-23(29)20-15(3)19-21(28)24-18(25-22(19)31-20)14-26(13-17(27)5-2)12-16-9-7-6-8-10-16/h4,6-10,17,27H,1,5,11-14H2,2-3H3,(H,24,25,28)