Vitas-M small molecule compound

2-({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-cyclohexylacetamide

Catalog ID
STL402984
SMILES O=C(NC1CCCCC1)CSc1nc2ccccc2c(=O)n1CCCn1cc(c(n1)C)Cl

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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 C23H28ClN5O2S MW 474.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28ClN5O2S/c1-16-19(24)14-28(27-16)12-7-13-29-22(31)18-10-5-6-11-20(18)26-23(29)32-15-21(30)25-17-8-3-2-4-9-17/h5-6,10-11,14,17H,2-4,7-9,12-13,15H2,1H3,(H,25,30)
InChIKey
PBEMWPIBCSQPCT-UHFFFAOYSA-N
Synonyms
1005703-63-8
1005703638
2((3(3(4chloro3methyl1Hpyrazol1yl)propyl)4oxo34dihydroquinazolin2yl)sulfanyl)Ncyclohexylacetamide
2(3(3(4chloro3methylpyrazol1yl)propyl)4oxoquinazolin2yl)sulfanylNcyclohexylacetamide
CC1=NN(C=C1Cl)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCCC4
InChI=1SC23H28ClN5O2Sc11619(24)1428(2716)127132922(31)1810561120(18)2623(29)321521(30)25178324917h5610111417H2479121315H21H3(H2530)
MFCD05667819
ZINC000002733912
ZINC02733912
ZINC2733912

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Available files

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