Vitas-M small molecule compound

3-chloro-N-{2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}-1-benzothiophene-2-carboxamide

Catalog ID
STK124289
SMILES O=C(c1ccccc1)N1CCN(CC1)c1ccccc1NC(=O)c1sc2c(c1Cl)cccc2

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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 C26H22ClN3O2S MW 476.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O2S/c27-23-19-10-4-7-13-22(19)33-24(23)25(31)28-20-11-5-6-12-21(20)29-14-16-30(17-15-29)26(32)18-8-2-1-3-9-18/h1-13H,14-17H2,(H,28,31)
InChIKey
DITCSPCSXZWUES-UHFFFAOYSA-N
Synonyms
587009-28-7
3CHLORON(2(4(PHENYLCARBONYL)PIPERAZIN1YL)PHENYL)1BENZOTHIOPHENE2CARBOXAMIDE
587009287
BENZO(B)THIOPHENE2CARBOXAMIDEN(2(4BENZOYL(PIPERAZIN1YL))PHENYL)3CHLORO
BENZO(B)THIOPHENE2CARBOXAMIDEN(2PHENYL)3CHLORO
C1CN(CCN1C2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C(=O)C5=CC=CC=C5
InChI=1SC26H22ClN3O2Sc27231910471322(19)3324(23)25(31)282011561221(20)29141630(171529)26(32)188213918h113H1417H2(H2831)
MFCD04032388
N(2(4BENZOYLPIPERAZIN1YL)PHENYL)3CHLORO1BENZO(B)THIOPHENE2CARBOXAMIDE
N(2(4BENZOYLPIPERAZIN1YL)PHENYL)3CHLORO1BENZOTHIOPHENE2CARBOXAMIDE
N(2(4benzoylpiperazin1yl)phenyl)3chlorobenzo(b)thiophene2carboxamide
ZINC000002395803
ZINC02395803
ZINC2395803

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Available files

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