Vitas-M small molecule compound
1-(3-chloro-2-methylphenyl)-3-(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)guanidine
Catalog ID
STK320820
SMILES N=C(Nc1nc2CCCCc2c(=O)[nH]1)Nc1cccc(c1C)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 C16H18ClN5O MW 331.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O/c1-9-11(17)6-4-8-12(9)19-15(18)22-16-20-13-7-3-2-5-10(13)14(23)21-16/h4,6,8H,2-3,5,7H2,1H3,(H4,18,19,20,21,22,23)InChIKey
XFXMKFLJXIFOAS-UHFFFAOYSA-NSynonyms
1(3chloro2methylphenyl)2(4oxo5678tetrahydro1Hquinazolin2yl)guanidine
1(3chloro2methylphenyl)3(4oxo345678hexahydroquinazolin2yl)guanidine
CC1=C(C=CC=C1Cl)NC(=NC2=NC(=O)C3=C(N2)CCCC3)N
InChI=1SC16H18ClN5Oc1911(17)64812(9)1915(18)22162013732510(13)14(23)2116h468H2357H21H3(H4181920212223)
MFCD08723464
N=C(Nc1nc2CCCCc2c(=O)(nH)1)Nc1cccc(c1C)Cl
ZINC000009938569
ZINC9938569
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