4-azanyl-3-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Openeye Name: 4-amino-3-[(2-chloro-7,8-dimethyl-3-quinolyl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-[(2-chloro-7,8-dimethyl-3-quinolinyl)methylthio]-6-methyl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-[(2-chloro-7,8-dimethylquinolin-3-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Traditional Name: 4-amino-3-[(2-chloro-7,8-dimethyl-3-quinolyl)methylthio]-6-methyl-1,2,4-triazin-5-one Formula: C16H16ClN5OS MolecularWeight: 361.84914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NN=C(C(=O)N3N)C)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NN=C(C(=O)N3N)C)Cl)C

InChI

InChI=1S/C16H16ClN5OS/c1-8-4-5-11-6-12(14(17)19-13(11)9(8)2)7-24-16-21-20-10(3)15(23)22(16)18/h4-6H,7,18H2,1-3H3