2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C20H20BrN5OS MolecularWeight: 458.3747

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3N)C4=CC=CC=C4Br

Isomeric SMILES

CC1CCC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3N)C4=CC=CC=C4Br

InChI

InChI=1S/C20H20BrN5OS/c1-13-10-11-14-6-2-5-9-17(14)25(13)18(27)12-28-20-24-23-19(26(20)22)15-7-3-4-8-16(15)21/h2-9,13H,10-12,22H2,1H3