Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(3-methylphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Catalog ID
STL264397
SMILES Cc1cccc(c1)N(C(=O)Nc1ccc(cc1)Cl)Cc1nnc2n1CCCCC2
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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 C22H24ClN5O MW 409.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O/c1-16-6-5-7-19(14-16)28(22(29)24-18-11-9-17(23)10-12-18)15-21-26-25-20-8-3-2-4-13-27(20)21/h5-7,9-12,14H,2-4,8,13,15H2,1H3,(H,24,29)InChIKey
HSWVNRJGGJNIAQ-UHFFFAOYSA-NSynonyms
((4CHLOROPHENYL)AMINO)N(3METHYLPHENYL)N(5H6H7H8H9H124TRIAZOLO(45A)AZAPERHYDROEPIN3YLMETHYL)CARBOXAMIDE
3(4chlorophenyl)1((6789tetrahydro5H(124)triazolo(43a)azepin3yl)methyl)1(mtolyl)urea
3(4chlorophenyl)1(3methylphenyl)1(6789tetrahydro5H(124)triazolo(43a)azepin3ylmethyl)urea
CC1=CC(=CC=C1)N(CC2=NN=C3N2CCCCC3)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC22H24ClN5Oc11665719(1416)28(22(29)241811917(23)101218)152126252083241327(20)21h5791214H2481315H21H3(H2429)
MFCD02252960
ZINC000001409678
ZINC01409678
ZINC1409678
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