Vitas-M small molecule compound

tert-butyl 2-{[(2E)-2-(2H-chromen-3-ylmethylidene)hydrazinyl]carbonyl}pyrrolidine-1-carboxylate (non-preferred name)

Catalog ID
STL241438
SMILES O=C(C1CCCN1C(=O)OC(C)(C)C)N/N=C/C1=Cc2c(OC1)cccc2

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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 C20H25N3O4 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O4/c1-20(2,3)27-19(25)23-10-6-8-16(23)18(24)22-21-12-14-11-15-7-4-5-9-17(15)26-13-14/h4-5,7,9,11-12,16H,6,8,10,13H2,1-3H3,(H,22,24)/b21-12+
InChIKey
AKYCXTNVJLTLCJ-CIAFOILYSA-N
Synonyms

(SE)tertbutyl2(2((2Hchromen3yl)methylene)hydrazinecarbonyl)pyrrolidine1carboxylate
CC(C)(C)OC(=O)N1CCCC1C(=O)NN=CC2=CC3=CC=CC=C3OC2
InChI=1SC20H25N3O4c120(23)2719(25)23106816(23)18(24)222112141115745917(15)261314h4579111216H681013H213H3(H2224)b2112+
MFCD24859106
O=C((C@@H)1CCCN1C(=O)OC(C)(C)C)NN=CC1=Cc2c(OC1)cccc2
O=C(C1CCCN1C(=O)OC(C)(C)C)NN=CC1=Cc2c(OC1)cccc2
tertbutyl2(((2E)2(2Hchromen3ylmethylidene)hydrazinyl)carbonyl)pyrrolidine1carboxylate(nonpreferredname)
tertbutyl2(((E)2Hchromen3ylmethylideneamino)carbamoyl)pyrrolidine1carboxylate
ZINC000005100552
ZINC000006615269

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Available files

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