4-azanyl-6-tert-butyl-3-ethylsulfanyl-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methyl-ethanamide

Systemtic Name: 4-azanyl-6-tert-butyl-3-ethylsulfanyl-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methyl-ethanamide Openeye Name: 4-amino-6-tert-butyl-3-ethylsulfanyl-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methyl-acetamide CAS Name: 4-amino-6-tert-butyl-3-(ethylthio)-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methylacetamide IUPAC Name: 4-amino-6-tert-butyl-3-ethylsulfanyl-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methylacetamide Traditional Name: 4-amino-6-tert-butyl-3-(ethylthio)-1,2,4-triazin-5-one; N-[2-(1,3-benzothiazol-2-yloxy)phenyl]-N-methyl-acetamide Formula: C25H30N6O3S2 MolecularWeight: 526.6741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(C(=O)N1N)C(C)(C)C.CC(=O)N(C)C1=CC=CC=C1OC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCSC1=NN=C(C(=O)N1N)C(C)(C)C.CC(=O)N(C)C1=CC=CC=C1OC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H14N2O2S.C9H16N4OS/c1-11(19)18(2)13-8-4-5-9-14(13)20-16-17-12-7-3-6-10-15(12)21-16;1-5-15-8-12-11-6(9(2,3)4)7(14)13(8)10/h3-10H,1-2H3;5,10H2,1-4H3