Vitas-M small molecule compound
3-({(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2-methylquinazolin-4(3H)-one
Catalog ID
STL170458
SMILES Clc1ccc(cc1)N1N=C(/C(=C/Nn2c(C)nc3c(c2=O)cccc3)/C1=O)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 C20H16ClN5O2 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O2/c1-12-17(20(28)26(24-12)15-9-7-14(21)8-10-15)11-22-25-13(2)23-18-6-4-3-5-16(18)19(25)27/h3-11,22H,1-2H3/b17-11-InChIKey
AQKZHWVIZRRYFI-BOPFTXTBSA-NSynonyms
3(((1(4CHLOROPHENYL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)AMINO)2METHYL4(3H)QUINAZOLINONE
3(((Z)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)2methylquinazolin4(3H)one
3(((Z)(1(4chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)2methylquinazolin4one
CC1=NN(C(=O)C1=CNN2C(=NC3=CC=CC=C3C2=O)C)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)N1N=C(C(=CNn2c(C)nc3c(c2=O)cccc3)C1=O)C
InChI=1SC20H16ClN5O2c11217(20(28)26(2412)159714(21)81015)11222513(2)2318643516(18)19(25)27h31122H12H3b1711
MFCD01019789
ZINC000004646455
ZINC4646455
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