Vitas-M small molecule compound
N-{3-[(4-benzylpiperazin-1-yl)carbonyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}-2-fluorobenzamide
Catalog ID
STK071048
SMILES O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccccc1F)N1CCN(CC1)Cc1ccccc1
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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 C28H30FN3O2S MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30FN3O2S/c29-23-13-8-7-11-21(23)26(33)30-27-25(22-12-5-2-6-14-24(22)35-27)28(34)32-17-15-31(16-18-32)19-20-9-3-1-4-10-20/h1,3-4,7-11,13H,2,5-6,12,14-19H2,(H,30,33)InChIKey
CDDIMHFKWZCJOF-UHFFFAOYSA-NSynonyms
C1CCC2=C(CC1)SC(=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5F
InChI=1SC28H30FN3O2Sc292313871121(23)26(33)302725(22125261424(22)3527)28(34)32171531(161832)192093141020h13471113H256121419H2(H3033)
MFCD01825409
N(3((4benzylpiperazin1yl)carbonyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)2fluorobenzamide
N(3(4benzylpiperazine1carbonyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)2fluorobenzamide
O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccccc1F)N1CCN(CC1)Cc1ccccc1
STK071048
ZINC000019772278
ZINC19772278
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