Vitas-M small molecule compound
1-cyclohexyl-1-(3-{[(1,3-dicyclohexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}propyl)-3-phenylthiourea
Catalog ID
STK164673
SMILES S=C(N(C1CCCCC1)CCCNC=C1C(=O)N(C2CCCCC2)C(=O)N(C1=O)C1CCCCC1)Nc1ccccc1
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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 C33H47N5O3S MW 593.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H47N5O3S/c39-30-29(31(40)38(28-20-11-4-12-21-28)33(41)37(30)27-18-9-3-10-19-27)24-34-22-13-23-36(26-16-7-2-8-17-26)32(42)35-25-14-5-1-6-15-25/h1,5-6,14-15,24,26-28,34H,2-4,7-13,16-23H2,(H,35,42)InChIKey
WOBXHXDSCDQLDX-UHFFFAOYSA-NSynonyms
1CYCLOHEXYL1(3(((13DICYCLOHEXYL246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)AMINO)PROPYL)3PHENYLTHIOUREA
1CYCLOHEXYL1(3((13DICYCLOHEXYL246TRIOXO13DIAZINAN5YLIDENE)METHYLAMINO)PROPYL)3PHENYLTHIOUREA
1CYCLOHEXYL1(3((13DICYCLOHEXYL246TRIOXOTETRAHYDROPYRIMIDIN5(6H)YLIDENE)METHYLAMINO)PROPYL)3PHENYLTHIOUREA
C1CCC(CC1)N2C(=O)C(=CNCCCN(C3CCCCC3)C(=S)NC4=CC=CC=C4)C(=O)N(C2=O)C5CCCCC5
InChI=1SC33H47N5O3Sc393029(31(40)38(2820114122128)33(41)37(30)271893101927)243422132336(26167281726)32(42)3525145161525h156141524262834H247131623H2(H3542)
MFCD03759892
ZINC000097948684
ZINC97948684
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