Vitas-M small molecule compound

(2E)-N-(4-nitrophenyl)-2-(2,3,3-trimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanamide

Catalog ID
STL326344
SMILES O=C(/C=C/1\c2ccccc2CC(N1C)(C)C)Nc1ccc(cc1)[N+](=O)[O-]

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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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c1-20(2)13-14-6-4-5-7-17(14)18(22(20)3)12-19(24)21-15-8-10-16(11-9-15)23(25)26/h4-12H,13H2,1-3H3,(H,21,24)/b18-12+
InChIKey
YCMLAANXRPQMBV-LDADJPATSA-N
Synonyms
330998-53-3
(2E)N(4nitrophenyl)2(233trimethyl34dihydroisoquinolin1(2H)ylidene)ethanamide
(2E)N(4NITROPHENYL)2(233TRIMETHYL4HISOQUINOLIN1YLIDENE)ACETAMIDE
(E)N(4nitrophenyl)2(233trimethyl34dihydroisoquinolin1(2H)ylidene)acetamide
330998533
CC1(CC2=CC=CC=C2C(=CC(=O)NC3=CC=C(C=C3)(N+)(=O)(O))N1C)C
InChI=1SC20H21N3O3c120(2)1314645717(14)18(22(20)3)1219(24)211581016(11915)23(25)26h412H13H213H3(H2124)b1812+
MFCD01085054
N(4NITROPHENYL)2(233TRIMETHYL(234TRIHYDROISOQUINOLYLIDENE))ACETAMIDE
O=C(C=C1c2ccccc2CC(N1C)(C)C)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000100707898
ZINC100707898

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Available files

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