Vitas-M small molecule compound
N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-3-propoxybenzamide
Catalog ID
STK023970
SMILES CCCOc1cccc(c1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[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 C21H23ClN4O4S MW 462.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O4S/c1-2-12-30-17-5-3-4-15(13-17)20(27)23-21(31)25-10-8-24(9-11-25)19-7-6-16(26(28)29)14-18(19)22/h3-7,13-14H,2,8-12H2,1H3,(H,23,27,31)InChIKey
ODMCBJAHSJBJSQ-UHFFFAOYSA-NSynonyms
CCCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
CCCOc1cccc(c1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC21H23ClN4O4Sc1212301753415(1317)20(27)2321(31)2510824(91125)197616(26(28)29)1418(19)22h371314H2812H21H3(H232731)
MFCD02630443
N((4(2CHLORO4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)3PROPOXYBENZAMIDE
N(4(2CHLORO4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)3PROPOXYBENZAMIDE
STK023970
ZINC000009113052
ZINC09113052
ZINC9113052
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