Vitas-M small molecule compound
2-({3-[(4-methyl-2-nitrophenoxy)methyl]phenyl}carbonyl)-N-[3-(morpholin-4-yl)propyl]hydrazinecarbothioamide
Catalog ID
STL177551
SMILES S=C(NNC(=O)c1cccc(c1)COc1ccc(cc1[N+](=O)[O-])C)NCCCN1CCOCC1
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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 C23H29N5O5S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O5S/c1-17-6-7-21(20(14-17)28(30)31)33-16-18-4-2-5-19(15-18)22(29)25-26-23(34)24-8-3-9-27-10-12-32-13-11-27/h2,4-7,14-15H,3,8-13,16H2,1H3,(H,25,29)(H2,24,26,34)InChIKey
GNLFAYZWXPUVCJ-UHFFFAOYSA-NSynonyms
828296-40-81((3((4methyl2nitrophenoxy)methyl)benzoyl)amino)3(3morpholin4ylpropyl)thiourea
2((3((4methyl2nitrophenoxy)methyl)phenyl)carbonyl)N(3(morpholin4yl)propyl)hydrazinecarbothioamide
828296408
CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)NNC(=S)NCCCN3CCOCC3)(N+)(=O)(O)
InChI=1SC23H29N5O5Sc1176721(20(1417)28(30)31)33161842519(1518)22(29)252623(34)2483927101232131127h2471415H381316H21H3(H2529)(H2242634)
MFCD04131581
S=C(NNC(=O)c1cccc(c1)COc1ccc(cc1(N+)(=O)(O))C)NCCCN1CCOCC1
ZINC000036611135
ZINC36611135
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