4-BR-2-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE

CAS No.
769151-16-8
CCD No.
CCD00487639
Formula
C21 H21 Br Cl N3 O2 S
MolWeight
494.839

Basic Information

Product Name: 4-BR-2-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
CAS: 769151-16-8
English Synonyms: 4-BR-2-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
MDL Number.: MFCD05153843
H bond acceptor: 5
H bond donor: 2
Smile: c1ccc(c(c1)C(=O)Oc2ccc(cc2/C=N/NC(=S)NC3CCCCC3)Br)Cl
InChi: InChI=1S/C21H21BrClN3O2S/c22-15-10-11-19(28-20(27)17-8-4-5-9-18(17)23)14(12-15)13-24-26-21(29)25-16-6-2-1-3-7-16/h4-5,8-13,16H,1-3,6-7H2,(H2,25,26,29)/b24-13+
InChiKey: InChIKey=IWWRQUSJEPTONO-ZMOGYAJESA-N

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