Vitas-M small molecule compound
3-phenylpropyl 5-[({2-[(4-ethoxyphenyl)carbamoyl]phenyl}carbamothioyl)amino]-5-oxopentanoate
Catalog ID
STL065287
SMILES CCOc1ccc(cc1)NC(=O)c1ccccc1NC(=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 C30H33N3O5S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O5S/c1-2-37-24-19-17-23(18-20-24)31-29(36)25-13-6-7-14-26(25)32-30(39)33-27(34)15-8-16-28(35)38-21-9-12-22-10-4-3-5-11-22/h3-7,10-11,13-14,17-20H,2,8-9,12,15-16,21H2,1H3,(H,31,36)(H2,32,33,34,39)InChIKey
HVDMRBSKMRDJCY-UHFFFAOYSA-NSynonyms
3phenylpropyl5(((2((4ethoxyphenyl)carbamoyl)phenyl)carbamothioyl)amino)5oxopentanoate
3PHENYLPROPYL5((2((4ETHOXYPHENYL)CARBAMOYL)PHENYL)CARBAMOTHIOYLAMINO)5OXOPENTANOATE
CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3
InChI=1SC30H33N3O5Sc123724191723(182024)3129(36)2513671426(25)3230(39)3327(34)1581628(35)382191222104351122h37101113141720H28912151621H21H3(H3136)(H232333439)
MFCD07083731
ZINC000097940412
ZINC97940412
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