Vitas-M small molecule compound

N-[(2E)-6-{[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonyl}-1,3-benzothiazol-2(3H)-ylidene]acetamide

Catalog ID
STK635878
SMILES CC(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)N1CCN(CC1)c1ccc(c(c1)Cl)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H18Cl2N4O2S MW 449.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N4O2S/c1-12(27)23-20-24-17-5-2-13(10-18(17)29-20)19(28)26-8-6-25(7-9-26)14-3-4-15(21)16(22)11-14/h2-5,10-11H,6-9H2,1H3,(H,23,24,27)
InChIKey
NGZIZDCLKDRPAI-UHFFFAOYSA-N
Synonyms
1010889-91-4
1010889914
CC(=O)N=c1(nH)c2c(s1)cc(cc2)C(=O)N1CCN(CC1)c1ccc(c(c1)Cl)Cl
CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl
InChI=1SC20H18Cl2N4O2Sc112(27)232024175213(1018(17)2920)19(28)268625(7926)143415(21)16(22)1114h251011H69H21H3(H232427)
MFCD18160878
N((2E)6((4(34dichlorophenyl)piperazin1yl)carbonyl)13benzothiazol2(3H)ylidene)acetamide
N(6(4(34dichlorophenyl)piperazine1carbonyl)13benzothiazol2yl)acetamide
ZINC000012323050
ZINC12323050

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Available files

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