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

Systemtic Name: 4-[[5-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[[5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[[5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[[5-[(4-chloro-3-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]carbostyril Formula: C21H19ClN4O2S MolecularWeight: 426.91916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NN=C(N2C)SCC3=CC(=O)NC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NN=C(N2C)SCC3=CC(=O)NC4=CC=CC=C43)Cl

InChI

InChI=1S/C21H19ClN4O2S/c1-13-9-15(7-8-17(13)22)28-11-19-24-25-21(26(19)2)29-12-14-10-20(27)23-18-6-4-3-5-16(14)18/h3-10H,11-12H2,1-2H3,(H,23,27)