5-BUTYL-4-(4-CHLOROBENZYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE

CAS No.
CCD No.
CCD00293437
Formula
C13 H16 Cl N3 S
MolWeight
281.809

Basic Information

Product Name: 5-BUTYL-4-(4-CHLOROBENZYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
English Synonyms: 5-BUTYL-4-(4-CHLOROBENZYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
MDL Number.: MFCD02170392
H bond acceptor: 3
H bond donor: 1
Smile: CCCCc1n[nH]c(=S)n1Cc2ccc(cc2)Cl
InChi: InChI=1S/C13H16ClN3S/c1-2-3-4-12-15-16-13(18)17(12)9-10-5-7-11(14)8-6-10/h5-8H,2-4,9H2,1H3,(H,16,18)
InChiKey: InChIKey=YJAPOVLCWSXABC-UHFFFAOYSA-N

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