propan-2-yl 5-methyl-4-oxidanylidene-2-[[2-oxidanylpentyl-(phenylmethyl)amino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 5-methyl-4-oxidanylidene-2-[[2-oxidanylpentyl-(phenylmethyl)amino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-[[benzyl(2-hydroxypentyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-hydroxypentyl-(phenylmethyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[benzyl(2-hydroxypentyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[benzyl(2-hydroxypentyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN(CC1=CC=CC=C1)CC2=NC3=C(C(=C(S3)C(=O)OC(C)C)C)C(=O)N2)O

Isomeric SMILES

CCCC(CN(CC1=CC=CC=C1)CC2=NC3=C(C(=C(S3)C(=O)OC(C)C)C)C(=O)N2)O

InChI

InChI=1S/C24H31N3O4S/c1-5-9-18(28)13-27(12-17-10-7-6-8-11-17)14-19-25-22(29)20-16(4)21(32-23(20)26-19)24(30)31-15(2)3/h6-8,10-11,15,18,28H,5,9,12-14H2,1-4H3,(H,25,26,29)