Vitas-M small molecule compound
2-{[(4-benzylpiperazin-1-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid
Catalog ID
STL235260
SMILES O=C(N1CCN(CC1)Cc1ccccc1)Nc1sc2c(c1C(=O)O)CCC2
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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 C20H23N3O3S MW 385.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O3S/c24-19(25)17-15-7-4-8-16(15)27-18(17)21-20(26)23-11-9-22(10-12-23)13-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,21,26)(H,24,25)InChIKey
CZKGMSCEGYTLSH-UHFFFAOYSA-NSynonyms
921083-91-22(((4benzylpiperazin1yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylicacid
2((4benzylpiperazin4ium1carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
2(4benzylpiperazine1carboxamido)56dihydro4Hcyclopenta(b)thiophene3carboxylicacid
921083912
C1CC2=C(C1)SC(=C2C(=O)(O))NC(=O)N3CC(NH+)(CC3)CC4=CC=CC=C4
InChI=1SC20H23N3O3Sc2419(25)171574816(15)2718(17)2120(26)2311922(101223)13145213614h1356H4713H2(H2126)(H2425)
MFCD08746253
ZINC000009303379
ZINC9303379
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