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

Systemtic Name: 3-[5-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(3-chloro-4-methyl-2-quinolyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C17H18ClN5OS MolecularWeight: 375.87572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C)CCC(=O)N)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C)CCC(=O)N)Cl

InChI

InChI=1S/C17H18ClN5OS/c1-10-11-5-3-4-6-12(11)20-13(16(10)18)9-25-17-22-21-15(23(17)2)8-7-14(19)24/h3-6H,7-9H2,1-2H3,(H2,19,24)