Vitas-M small molecule compound
tert-butyl (3S)-3-({2-[(4-methylphenyl)amino]-2-oxoethyl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK575519
SMILES O=C(Nc1ccc(cc1)C)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(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 C24H29N3O4 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O4/c1-16-9-11-19(12-10-16)26-21(28)14-25-22(29)20-13-17-7-5-6-8-18(17)15-27(20)23(30)31-24(2,3)4/h5-12,20H,13-15H2,1-4H3,(H,25,29)(H,26,28)/t20-/m0/s1InChIKey
ZREGNZVNWACHHI-FQEVSTJZSA-NSynonyms
1173683-35-6(S)tertbutyl3((2oxo2(ptolylamino)ethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173683356
CC1=CC=C(C=C1)NC(=O)CNC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
InChI=1SC24H29N3O4c11691119(121016)2621(28)142522(29)201317756818(17)1527(20)23(30)3124(23)4h51220H1315H214H3(H2529)(H2628)t20m0s1
MFCD06778590
O=C(Nc1ccc(cc1)C)CNC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C
tertbutyl(3S)3((2((4methylphenyl)amino)2oxoethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3((2(4methylanilino)2oxoethyl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000005302631
ZINC05302631
ZINC5302631
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