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

Systemtic Name: 2-(4-methoxyphenyl)-3-prop-2-enyl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-allyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 2-(4-methoxyphenyl)-3-prop-2-enylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 2-(4-methoxyphenyl)-3-prop-2-enylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-allyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C21H16N2O3S MolecularWeight: 376.42834

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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)N2CC=C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC=C

InChI

InChI=1S/C21H16N2O3S/c1-3-12-23-19(13-8-10-14(26-2)11-9-13)22-20-17(21(23)25)18(24)15-6-4-5-7-16(15)27-20/h3-11H,1,12H2,2H3