Vitas-M small molecule compound
4-(4-chlorophenyl)-N-[3-methyl-1-oxo-1-(4H-1,2,4-triazol-3-ylamino)butan-2-yl]piperazine-1-carboxamide
Catalog ID
STL248445
SMILES CC(C(C(=O)Nc1[nH]cnn1)NC(=O)N1CCN(CC1)c1ccc(cc1)Cl)C
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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 C18H24ClN7O2 MW 405.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24ClN7O2/c1-12(2)15(16(27)23-17-20-11-21-24-17)22-18(28)26-9-7-25(8-10-26)14-5-3-13(19)4-6-14/h3-6,11-12,15H,7-10H2,1-2H3,(H,22,28)(H2,20,21,23,24,27)InChIKey
ZKHGASDQABBEFH-UHFFFAOYSA-NSynonyms
(S)N(1((4H124triazol3yl)amino)3methyl1oxobutan2yl)4(4chlorophenyl)piperazine1carboxamide
4(4chlorophenyl)N(3methyl1oxo1(1H124triazol5ylamino)butan2yl)piperazine1carboxamide
4(4chlorophenyl)N(3methyl1oxo1(4H124triazol3ylamino)butan2yl)piperazine1carboxamide
CC((C@@H)(C(=O)Nc1(nH)cnn1)NC(=O)N1CCN(CC1)c1ccc(cc1)Cl)C
CC(C(C(=O)Nc1(nH)cnn1)NC(=O)N1CCN(CC1)c1ccc(cc1)Cl)C
CC(C)C(C(=O)NC1=NC=NN1)NC(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl
InChI=1SC18H24ClN7O2c112(2)15(16(27)23172011212417)2218(28)269725(81026)145313(19)4614h36111215H710H212H3(H2228)(H22021232427)
MFCD24861198
ZINC000079494543
ZINC000080333344
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