Vitas-M small molecule compound
N-[3-(2-methylpropyl)-4-oxo-3,4-dihydroquinazolin-6-yl]-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
Catalog ID
STL473358
SMILES CC(Cn1cnc2c(c1=O)cc(cc2)NC(=O)CCCCC1SCC2C1NC(=O)N2)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 C22H29N5O3S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O3S/c1-13(2)10-27-12-23-16-8-7-14(9-15(16)21(27)29)24-19(28)6-4-3-5-18-20-17(11-31-18)25-22(30)26-20/h7-9,12-13,17-18,20H,3-6,10-11H2,1-2H3,(H,24,28)(H2,25,26,30)InChIKey
ZVWNORROGGUXBB-UHFFFAOYSA-NSynonyms
CC(C)CN1C=NC2=C(C1=O)C=C(C=C2)NC(=O)CCCCC3C4C(CS3)NC(=O)N4
CC(Cn1cnc2c(c1=O)cc(cc2)NC(=O)CCCC(C@@H)1SC(C@H)2(C@@H)1NC(=O)N2)C
InChI=1SC22H29N5O3Sc113(2)10271223168714(915(16)21(27)29)2419(28)6435182017(113118)2522(30)2620h791213171820H361011H212H3(H2428)(H2252630)
MFCD31751219
N(3(2methylpropyl)4oxo34dihydroquinazolin6yl)5(2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(3(2methylpropyl)4oxoquinazolin6yl)5(2oxo133a466ahexahydrothieno(34d)imidazol4yl)pentanamide
N(3isobutyl4oxo34dihydroquinazolin6yl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
ZINC000096115490
ZINC000334162842
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