6-chloranyl-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-4-phenyl-carbostyril Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NN=C(N1C2CC2)SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C21H17ClN4OS/c1-12-24-25-21(26(12)15-8-9-15)28-19-18(13-5-3-2-4-6-13)16-11-14(22)7-10-17(16)23-20(19)27/h2-7,10-11,15H,8-9H2,1H3,(H,23,27)