Vitas-M small molecule compound
3-phenylpropyl 5-[({2-[(naphthalen-2-yloxy)acetyl]hydrazinyl}carbonothioyl)amino]-5-oxopentanoate
Catalog ID
STL065289
SMILES O=C(NC(=S)NNC(=O)COc1ccc2c(c1)cccc2)CCCC(=O)OCCCc1ccccc1
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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 C27H29N3O5S MW 507.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O5S/c31-24(13-6-14-26(33)34-17-7-10-20-8-2-1-3-9-20)28-27(36)30-29-25(32)19-35-23-16-15-21-11-4-5-12-22(21)18-23/h1-5,8-9,11-12,15-16,18H,6-7,10,13-14,17,19H2,(H,29,32)(H2,28,30,31,36)InChIKey
GQQRMZRLIGTMPJ-UHFFFAOYSA-NSynonyms
3phenylpropyl5(((2((naphthalen2yloxy)acetyl)hydrazinyl)carbonothioyl)amino)5oxopentanoate
3PHENYLPROPYL5(((2NAPHTHALEN2YLOXYACETYL)AMINO)CARBAMOTHIOYLAMINO)5OXOPENTANOATE
C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC(=S)NNC(=O)COC2=CC3=CC=CC=C3C=C2
InChI=1SC27H29N3O5Sc3124(1361426(33)3417710208213920)2827(36)302925(32)19352316152111451222(21)1823h15891112151618H671013141719H2(H2932)(H228303136)
MFCD07083777
ZINC000012137606
ZINC12137606
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