3-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[(3-chloro-4-methyl-2-quinolyl)methylthio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Formula: C17H19ClN4O2S MolecularWeight: 378.87636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NNC(=O)N3CCCOC)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NNC(=O)N3CCCOC)Cl

InChI

InChI=1S/C17H19ClN4O2S/c1-11-12-6-3-4-7-13(12)19-14(15(11)18)10-25-17-21-20-16(23)22(17)8-5-9-24-2/h3-4,6-7H,5,8-10H2,1-2H3,(H,20,23)