Vitas-M small molecule compound

N-(3,4-dimethylphenyl)-2-(3-oxo-1-{(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide

Catalog ID
STK823533
SMILES O=C(CC1C(=O)Nc2c(N1C(=O)/C=C/c1ccc(cc1)C(C)C)cccc2)Nc1ccc(c(c1)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 C30H31N3O3 MW 481.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O3/c1-19(2)23-13-10-22(11-14-23)12-16-29(35)33-26-8-6-5-7-25(26)32-30(36)27(33)18-28(34)31-24-15-9-20(3)21(4)17-24/h5-17,19,27H,18H2,1-4H3,(H,31,34)(H,32,36)/b16-12+
InChIKey
CIQCFSYGSXGZMJ-FOWTUZBSSA-N
Synonyms

CC1=C(C=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2C(=O)C=CC4=CC=C(C=C4)C(C)C)C
InChI=1SC30H31N3O3c119(2)23131022(111423)121629(35)3326865725(26)3230(36)27(33)1828(34)312415920(3)21(4)1724h5171927H18H214H3(H3134)(H3236)b1612+
MFCD03464037
N(34dimethylphenyl)2(3oxo1((2E)3(4(propan2yl)phenyl)prop2enoyl)1234tetrahydroquinoxalin2yl)acetamide
N(34dimethylphenyl)2(3oxo1((E)3(4propan2ylphenyl)prop2enoyl)24dihydroquinoxalin2yl)acetamide
O=C(CC1C(=O)Nc2c(N1C(=O)C=Cc1ccc(cc1)C(C)C)cccc2)Nc1ccc(c(c1)C)C
ZINC000019927906
ZINC000019927909

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Available files

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