Vitas-M small molecule compound

N~2~-cyclopropyl-N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-N-[4-(morpholin-4-yl)phenyl]glycinamide

Catalog ID
STL439345
SMILES O=C(CN(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)C1CC1)Nc1ccc(cc1)N1CCOCC1

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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 C31H38N4O3 MW 514.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N4O3/c1-20-29(24-6-4-5-7-26(24)32-20)30-25(31(30,2)3)18-28(37)35(23-12-13-23)19-27(36)33-21-8-10-22(11-9-21)34-14-16-38-17-15-34/h4-11,23,25,30,32H,12-19H2,1-3H3,(H,33,36)
InChIKey
UDWUUPNXZZHQEM-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC(=O)NC4=CC=C(C=C4)N5CCOCC5)C6CC6
InChI=1SC31H38N4O3c12029(24645726(24)3220)3025(31(302)3)1828(37)35(23121323)1927(36)332181022(11921)34141638171534h41123253032H1219H213H3(H3336)
MFCD29709747
N~2~cyclopropylN~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)N(4(morpholin4yl)phenyl)glycinamide
NCYCLOPROPYL2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(2(4MORPHOLINOPHENYLAMINO)2OXOETHYL)ACETAMIDE
NCYCLOPROPYL2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(2(4MORPHOLIN4YLANILINO)2OXOETHYL)ACETAMIDE
O=C(CN(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)C1CC1)Nc1ccc(cc1)N1CCOCC1
ZINC000001414650
ZINC000016949583

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Available files

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