3-(4-ethylphenyl)-1-[(3-fluorophenyl)methyl]-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-(4-ethylphenyl)-1-[(3-fluorophenyl)methyl]-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-(4-ethylphenyl)-1-[(3-fluorophenyl)methyl]benzothiopheno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-(4-ethylphenyl)-1-[(3-fluorophenyl)methyl]-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-(4-ethylphenyl)-1-[(3-fluorophenyl)methyl]-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-(4-ethylphenyl)-1-(3-fluorobenzyl)benzothiopheno[3,2-d]pyrimidine-2,4-quinone Formula: C25H19FN2O2S MolecularWeight: 430.493963

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4S3)N(C2=O)CC5=CC(=CC=C5)F

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4S3)N(C2=O)CC5=CC(=CC=C5)F

InChI

InChI=1S/C25H19FN2O2S/c1-2-16-10-12-19(13-11-16)28-24(29)23-22(20-8-3-4-9-21(20)31-23)27(25(28)30)15-17-6-5-7-18(26)14-17/h3-14H,2,15H2,1H3