Vitas-M small molecule compound
2-[(2E)-2-benzylidenehydrazinyl]-7-tert-butyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK698849
SMILES O=c1c2c(sc3c2CCC(C3)C(C)(C)C)nc(n1c1ccccc1)N/N=C/c1ccccc1
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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 C27H28N4OS MW 456.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4OS/c1-27(2,3)19-14-15-21-22(16-19)33-24-23(21)25(32)31(20-12-8-5-9-13-20)26(29-24)30-28-17-18-10-6-4-7-11-18/h4-13,17,19H,14-16H2,1-3H3,(H,29,30)/b28-17+InChIKey
FPRHXMMPPWQUSZ-OGLMXYFKSA-NSynonyms
354992-63-5(E)2(2benzylidenehydrazinyl)7(tertbutyl)3phenyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((2E)2benzylidenehydrazinyl)7tertbutyl3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((2E)2benzylidenehydrazinyl)7tertbutyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
354992635
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)NN=CC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC27H28N4OSc127(23)1914152122(1619)332423(21)25(32)31(20128591320)26(2924)30281718106471118h4131719H1416H213H3(H2930)b2817+
MFCD01897855
O=c1c2c(sc3c2CCC(C3)C(C)(C)C)nc(n1c1ccccc1)NN=Cc1ccccc1
ZINC000008431851
ZINC000008431852
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