Vitas-M small molecule compound
3-(3-chloro-4-methylphenyl)-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK168195
SMILES O=C1N(c2ccc(c(c2)Cl)C)C(Nc2c1cccc2)c1cccc(c1)[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 C21H16ClN3O3 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O3/c1-13-9-10-15(12-18(13)22)24-20(14-5-4-6-16(11-14)25(27)28)23-19-8-3-2-7-17(19)21(24)26/h2-12,20,23H,1H3InChIKey
OUFOYPRTPACSLK-UHFFFAOYSA-NSynonyms
(2R)3(3CHLORO4METHYLPHENYL)2(3NITROPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
3(3CHLORO4METHYLPHENYL)2(3NITROPHENYL)12DIHYDROQUINAZOLIN4ONE
3(3CHLORO4METHYLPHENYL)2(3NITROPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
CC1=C(C=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC21H16ClN3O3c11391015(1218(13)22)2420(1454616(1114)25(27)28)2319832717(19)21(24)26h2122023H1H3
MFCD01204817
O=C1N(c2ccc(c(c2)Cl)C)C(Nc2c1cccc2)c1cccc(c1)(N+)(=O)(O)
ZINC000001177742
ZINC000001177743
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