Vitas-M small molecule compound

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

Catalog ID
STK457403
SMILES NC(=O)c1c(sc2c1CCCCCC2)NC(=O)C(C)(C)C

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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 C16H24N2O2S MW 308.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N2O2S/c1-16(2,3)15(20)18-14-12(13(17)19)10-8-6-4-5-7-9-11(10)21-14/h4-9H2,1-3H3,(H2,17,19)(H,18,20)
InChIKey
PTZHJLPCNIYVLR-UHFFFAOYSA-N
Synonyms

2((22dimethylpropanoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2(22dimethylpropanoylamino)456789hexahydrocycloocta(b)thiophene3carboxamide
CC(C)(C)C(=O)NC1=C(C2=C(S1)CCCCCC2)C(=O)N
InChI=1SC16H24N2O2Sc116(23)15(20)181412(13(17)19)1086457911(10)2114h49H213H3(H21719)(H1820)
MFCD03383444
ZINC000005900830
ZINC05900830
ZINC5900830

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.