2-(4-methoxyphenyl)-3-(phenylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 2-(4-methoxyphenyl)-3-(phenylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-benzyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 2-(4-methoxyphenyl)-3-(phenylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-benzyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-benzyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C25H18N2O3S MolecularWeight: 426.48702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC5=CC=CC=C5

InChI

InChI=1S/C25H18N2O3S/c1-30-18-13-11-17(12-14-18)23-26-24-21(22(28)19-9-5-6-10-20(19)31-24)25(29)27(23)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3