4-azanyl-3-[(4-bromophenyl)methylsulfanyl]-6-(phenylmethyl)-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-[(4-bromophenyl)methylsulfanyl]-6-(phenylmethyl)-1,2,4-triazin-5-one Openeye Name: 4-amino-6-benzyl-3-[(4-bromophenyl)methylsulfanyl]-1,2,4-triazin-5-one CAS Name: 4-amino-3-[(4-bromophenyl)methylthio]-6-(phenylmethyl)-1,2,4-triazin-5-one IUPAC Name: 4-amino-6-benzyl-3-[(4-bromophenyl)methylsulfanyl]-1,2,4-triazin-5-one Traditional Name: 4-amino-6-benzyl-3-[(4-bromobenzyl)thio]-1,2,4-triazin-5-one Formula: C17H15BrN4OS MolecularWeight: 403.2962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N(C2=O)N)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N(C2=O)N)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4OS/c18-14-8-6-13(7-9-14)11-24-17-21-20-15(16(23)22(17)19)10-12-4-2-1-3-5-12/h1-9H,10-11,19H2