Vitas-M small molecule compound

N-[3-(cyclopropylcarbamoyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]-2-(pyridin-4-yl)quinoline-4-carboxamide

Catalog ID
STK460025
SMILES O=C(c1c(sc2c1CCCCCC2)NC(=O)c1cc(nc2c1cccc2)c1ccncc1)NC1CC1

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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 C29H28N4O2S MW 496.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O2S/c34-27(22-17-24(18-13-15-30-16-14-18)32-23-9-6-5-7-20(22)23)33-29-26(28(35)31-19-11-12-19)21-8-3-1-2-4-10-25(21)36-29/h5-7,9,13-17,19H,1-4,8,10-12H2,(H,31,35)(H,33,34)
InChIKey
DVHIUFFSZVHMAU-UHFFFAOYSA-N
Synonyms

C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5)C(=O)NC6CC6
InChI=1SC29H28N4O2Sc3427(221724(18131530161418)3223965720(22)23)332926(28(35)3119111219)21831241025(21)3629h579131719H1481012H2(H3135)(H3334)
MFCD05999806
N(3(cyclopropylcarbamoyl)456789hexahydrocycloocta(b)thiophen2yl)2(pyridin4yl)quinoline4carboxamide
N(3(cyclopropylcarbamoyl)456789hexahydrocycloocta(b)thiophen2yl)2pyridin4ylquinoline4carboxamide
ZINC000006457488
ZINC06457488
ZINC6457488

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Available files

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