Vitas-M small molecule compound

N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide

Catalog ID
STL476941
SMILES O=C1NC2C(N1)C(SC2)CCCCC(=O)NC(c1nc2c([nH]1)cccc2)Cc1ccccc1

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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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c31-22(13-7-6-12-21-23-20(15-33-21)29-25(32)30-23)26-19(14-16-8-2-1-3-9-16)24-27-17-10-4-5-11-18(17)28-24/h1-5,8-11,19-21,23H,6-7,12-15H2,(H,26,31)(H,27,28)(H2,29,30,32)
InChIKey
VAMBEHZAPYHZGG-UHFFFAOYSA-N
Synonyms

C1C2C(C(S1)CCCCC(=O)NC(CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4)NC(=O)N2
InChI=1SC25H29N5O2Sc3122(137612212320(153321)2925(32)3023)2619(14168213916)24271710451118(17)2824h15811192123H671215H2(H2631)(H2728)(H2293032)
MFCD31751390
N((S)1(1Hbenzo(d)imidazol2yl)2phenylethyl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(1(1Hbenzimidazol2yl)2phenylethyl)5(2oxo133a466ahexahydrothieno(34d)imidazol4yl)pentanamide
N(1(1Hbenzimidazol2yl)2phenylethyl)5(2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
O=C1N(C@@H)2(C@H)(N1)(C@@H)(SC2)CCCCC(=O)N(C@H)(c1nc2c((nH)1)cccc2)Cc1ccccc1
O=C1NC2C(N1)C(SC2)CCCCC(=O)NC(c1nc2c((nH)1)cccc2)Cc1ccccc1
ZINC000031044119
ZINC000334161149

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Available files

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