Vitas-M small molecule compound
1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone
Catalog ID
STK154175
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)CSc1nc2c(s1)cc(cc2)[N+](=O)[O-]
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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 C19H17ClN4O3S2 MW 448.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O3S2/c20-13-2-1-3-14(10-13)22-6-8-23(9-7-22)18(25)12-28-19-21-16-5-4-15(24(26)27)11-17(16)29-19/h1-5,10-11H,6-9,12H2InChIKey
CLHKWRXTVIELSM-UHFFFAOYSA-NSynonyms
1(4(3CHLOROPHENYL)PIPERAZIN1YL)2((6NITRO13BENZOTHIAZOL2YL)SULFANYL)ETHANONE
C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=NC4=C(S3)C=C(C=C4)(N+)(=O)(O)
Clc1cccc(c1)N1CCN(CC1)C(=O)CSc1nc2c(s1)cc(cc2)(N+)(=O)(O)
InChI=1SC19H17ClN4O3S2c201321314(1013)226823(9722)18(25)12281921165415(24(26)27)1117(16)2919h151011H6912H2
MFCD03870218
ZINC000001130602
ZINC01130602
ZINC1130602
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