6-chloranyl-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinolin-4-one

Systemtic Name: 6-chloranyl-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 6-chloro-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinolin-4-one CAS Name: 6-chloro-2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1H-quinolin-4-one IUPAC Name: 6-chloro-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 6-chloro-2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]-4-quinolone Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC2=CC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CCC1=NC(=NN1)SCC2=CC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C14H13ClN4OS/c1-2-13-17-14(19-18-13)21-7-9-6-12(20)10-5-8(15)3-4-11(10)16-9/h3-6H,2,7H2,1H3,(H,16,20)(H,17,18,19)