3-phenethyl-1-(phenylmethyl)-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-phenethyl-1-(phenylmethyl)-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Openeye Name: 1-benzyl-3-phenethyl-benzothiopheno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-phenethyl-1-(phenylmethyl)-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione IUPAC Name: 1-benzyl-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Traditional Name: 1-benzyl-3-phenethyl-benzothiopheno[3,2-d]pyrimidine-2,4-quinone Formula: C25H20N2O2S MolecularWeight: 412.5035

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C4=CC=CC=C4S3)N(C2=O)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C4=CC=CC=C4S3)N(C2=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H20N2O2S/c28-24-23-22(20-13-7-8-14-21(20)30-23)27(17-19-11-5-2-6-12-19)25(29)26(24)16-15-18-9-3-1-4-10-18/h1-14H,15-17H2