8-bromanyl-2-[[(3-hydroxyphenyl)amino]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 8-bromanyl-2-[[(3-hydroxyphenyl)amino]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 8-bromo-2-[(3-hydroxyanilino)methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 8-bromo-2-[(3-hydroxyanilino)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 8-bromo-2-[(3-hydroxyanilino)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 8-bromo-2-[(3-hydroxyanilino)methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C17H12BrN3O2S MolecularWeight: 402.26508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NCC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Br

Isomeric SMILES

C1=CC(=CC(=C1)O)NCC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Br

InChI

InChI=1S/C17H12BrN3O2S/c18-9-4-5-13-12(6-9)15-16(24-13)17(23)21-14(20-15)8-19-10-2-1-3-11(22)7-10/h1-7,19,22H,8H2,(H,20,21,23)