propyl 4-[(6-methyl-4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: propyl 4-[(6-methyl-4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzoate Openeye Name: propyl 4-[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-keto-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]benzoic acid propyl ester Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CSC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CSC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C24H22N2O3S2/c1-3-13-29-23(28)18-11-9-16(10-12-18)14-30-24-25-21(27)20-19(15(2)31-22(20)26-24)17-7-5-4-6-8-17/h4-12H,3,13-14H2,1-2H3,(H,25,26,27)