N-(3-bromophenyl)-7-methoxy-[1]benzothiolo[3,2-d]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-7-methoxy-[1]benzothiolo[3,2-d]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-7-methoxy-benzothiopheno[3,2-d]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-7-methoxy-[1]benzothiolo[3,2-d]pyrimidin-4-amine IUPAC Name: N-(3-bromophenyl)-7-methoxy-[1]benzothiolo[3,2-d]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-(7-methoxybenzothiopheno[3,2-d]pyrimidin-4-yl)amine Formula: C17H12BrN3OS MolecularWeight: 386.26568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(S2)C(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(S2)C(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C17H12BrN3OS/c1-22-12-5-6-13-14(8-12)23-16-15(13)19-9-20-17(16)21-11-4-2-3-10(18)7-11/h2-9H,1H3,(H,19,20,21)