Vitas-M small molecule compound
tert-butyl 2-(4-tert-butylphenyl)-3-thioxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate
Catalog ID
STL134119
SMILES O=C(N1CCC2(CC1)N=C(C(=S)N2)c1ccc(cc1)C(C)(C)C)OC(C)(C)C
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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 C22H31N3O2S MW 401.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N3O2S/c1-20(2,3)16-9-7-15(8-10-16)17-18(28)24-22(23-17)11-13-25(14-12-22)19(26)27-21(4,5)6/h7-10H,11-14H2,1-6H3,(H,24,28)InChIKey
CKZJJYWVNAAFLW-UHFFFAOYSA-NSynonyms
892295-79-3892295793
CC(C)(C)C1=CC=C(C=C1)C2=NC3(CCN(CC3)C(=O)OC(C)(C)C)NC2=S
InChI=1SC22H31N3O2Sc120(23)169715(81016)1718(28)2422(2317)111325(141222)19(26)2721(45)6h710H1114H216H3(H2428)
MFCD14726820
TERTBUTYL2(4(TERTBUTYL)PHENYL)3THIOXO148TRIAZASPIRO(45)DEC1ENE8CARBOXYLATE
TERTBUTYL2(4TERTBUTYLPHENYL)3SULFANYLIDENE148TRIAZASPIRO(45)DEC1ENE8CARBOXYLATE
tertbutyl2(4tertbutylphenyl)3thioxo148triazaspiro(45)dec1ene8carboxylate
tertbutyl3(4tertbutylphenyl)2sulfanylidene148triazaspiro(45)dec3ene8carboxylate
ZINC000006817131
ZINC6817131
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