2-[(4-bromophenyl)sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(4-bromophenyl)sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Openeye Name: 2-[(4-bromophenyl)sulfanylmethyl]-1H-benzofuro[3,2-d]pyrimidin-4-one CAS Name: 2-[[(4-bromophenyl)thio]methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(4-bromophenyl)sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(4-bromophenyl)thio]methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one Formula: C17H11BrN2O2S MolecularWeight: 387.25044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=O)N=C(N3)CSC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=O)N=C(N3)CSC4=CC=C(C=C4)Br

InChI

InChI=1S/C17H11BrN2O2S/c18-10-5-7-11(8-6-10)23-9-14-19-15-12-3-1-2-4-13(12)22-16(15)17(21)20-14/h1-8H,9H2,(H,19,20,21)