Vitas-M small molecule compound
3-phenylpropyl 5-[({2-[4-(benzylamino)-4-oxobutanoyl]hydrazinyl}carbonothioyl)amino]-5-oxopentanoate
Catalog ID
STL065293
SMILES O=C(CCC(=O)NCc1ccccc1)NNC(=S)NC(=O)CCCC(=O)OCCCc1ccccc1
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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 C26H32N4O5S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O5S/c31-22(27-19-21-11-5-2-6-12-21)16-17-24(33)29-30-26(36)28-23(32)14-7-15-25(34)35-18-8-13-20-9-3-1-4-10-20/h1-6,9-12H,7-8,13-19H2,(H,27,31)(H,29,33)(H2,28,30,32,36)InChIKey
WMBBDCIYOBXEKU-UHFFFAOYSA-NSynonyms
3phenylpropyl5(((2(4(benzylamino)4oxobutanoyl)hydrazinyl)carbonothioyl)amino)5oxopentanoate
3PHENYLPROPYL5(((4(BENZYLAMINO)4OXOBUTANOYL)AMINO)CARBAMOTHIOYLAMINO)5OXOPENTANOATE
C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC(=S)NNC(=O)CCC(=O)NCC2=CC=CC=C2
InChI=1SC26H32N4O5Sc3122(271921115261221)161724(33)293026(36)2823(32)1471525(34)35188132093141020h16912H781319H2(H2731)(H2933)(H228303236)
MFCD07083790
ZINC000012137575
ZINC12137575
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