Vitas-M small molecule compound

2-[(2-phenylbutanoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

Catalog ID
STK432310
SMILES CCC(C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2)c1ccccc1

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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 C21H26N2O2S MW 370.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O2S/c1-2-15(14-10-6-5-7-11-14)20(25)23-21-18(19(22)24)16-12-8-3-4-9-13-17(16)26-21/h5-7,10-11,15H,2-4,8-9,12-13H2,1H3,(H2,22,24)(H,23,25)
InChIKey
CKHXZKYUDZLOQX-UHFFFAOYSA-N
Synonyms

2((2phenylbutanoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2(2phenylbutanoylamino)456789hexahydrocycloocta(b)thiophene3carboxamide
CCC(C1=CC=CC=C1)C(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)N
InChI=1SC21H26N2O2Sc1215(14106571114)20(25)232118(19(22)24)161283491317(16)2621h57101115H24891213H21H3(H22224)(H2325)
MFCD01349726
ZINC000000688867
ZINC000000688868

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Available files

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