Vitas-M small molecule compound
tert-butyl [(4-{[(2Z)-2-(6'-methyl-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene)hydrazinyl]carbonyl}cyclohexyl)methyl]carbamate
Catalog ID
STL200196
SMILES O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)N/N=c\1/cc(C)c2c(o1)cc1c(c2)CCC2(O1)CCCCC2
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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 C31H43N3O5 MW 537.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H43N3O5/c1-20-16-27(33-34-28(35)22-10-8-21(9-11-22)19-32-29(36)39-30(2,3)4)37-26-18-25-23(17-24(20)26)12-15-31(38-25)13-6-5-7-14-31/h16-18,21-22H,5-15,19H2,1-4H3,(H,32,36)(H,34,35)/b33-27-InChIKey
XHOPPIZNZLDSAJ-KGGMANCPSA-NSynonyms
(E)tertbutyl((4(2(6methyl3Hspiro(cyclohexane12pyrano(32g)chromen)8(4H)ylidene)hydrazinecarbonyl)cyclohexyl)methyl)carbamate
CC1=CC(=NNC(=O)C2CCC(CC2)CNC(=O)OC(C)(C)C)OC3=CC4=C(CCC5(O4)CCCCC5)C=C13
InChI=1SC31H43N3O5c1201627(333428(35)2210821(91122)193229(36)3930(23)4)3726182523(1724(20)26)121531(3825)136571431h16182122H51519H214H3(H3236)(H3435)b3327
MFCD24858126
O=C(OC(C)(C)C)NC(C@@H)1CCC(CC1)C(=O)NN=c1cc(C)c2c(o1)cc1c(c2)CCC2(O1)CCCCC2
O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)NN=c1cc(C)c2c(o1)cc1c(c2)CCC2(O1)CCCCC2
tertbutyl((4(((2Z)2(6methyl34dihydro8Hspiro(cyclohexane12pyrano(32g)chromen)8ylidene)hydrazinyl)carbonyl)cyclohexyl)methyl)carbamate
tertbutylN((4(((Z)(6methylspiro(34dihydropyrano(32g)chromene21cyclohexane)8ylidene)amino)carbamoyl)cyclohexyl)methyl)carbamate
ZINC000059732313
ZINC13655207
Check stock
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Check stock on Vitas-MAvailable files
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