Vitas-M small molecule compound
N-{3-[(2,5-dimethoxyphenyl)carbamoyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl}-1-ethyl-1H-pyrazole-3-carboxamide
Catalog ID
STK445419
SMILES CCn1ccc(n1)C(=O)Nc1sc2c(c1C(=O)Nc1cc(OC)ccc1OC)CCCCCC2
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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 C25H30N4O4S MW 482.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O4S/c1-4-29-14-13-18(28-29)23(30)27-25-22(17-9-7-5-6-8-10-21(17)34-25)24(31)26-19-15-16(32-2)11-12-20(19)33-3/h11-15H,4-10H2,1-3H3,(H,26,31)(H,27,30)InChIKey
MXULYKQOFRRNFE-UHFFFAOYSA-NSynonyms
CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)NC4=C(C=CC(=C4)OC)OC
InChI=1SC25H30N4O4Sc1429141318(2829)23(30)272522(17975681021(17)3425)24(31)26191516(322)111220(19)333h1115H410H213H3(H2631)(H2730)
MFCD04058142
N(3((25dimethoxyphenyl)carbamoyl)456789hexahydrocycloocta(b)thiophen2yl)1ethyl1Hpyrazole3carboxamide
N(3((25dimethoxyphenyl)carbamoyl)456789hexahydrocycloocta(b)thiophen2yl)1ethylpyrazole3carboxamide
ZINC000020215413
ZINC20215413
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