Vitas-M small molecule compound
2-{[(8E)-8-(4-methoxybenzylidene)-4-(4-methoxyphenyl)-3,4,5,6,7,8-hexahydroquinazolin-2-yl]sulfanyl}-N-methyl-N-phenylacetamide
Catalog ID
STL115138
SMILES COc1ccc(cc1)C1NC(=NC2=C1CCC/C/2=C\c1ccc(cc1)OC)SCC(=O)N(c1ccccc1)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 C32H33N3O3S MW 539.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O3S/c1-35(25-9-5-4-6-10-25)29(36)21-39-32-33-30(23-14-18-27(38-3)19-15-23)28-11-7-8-24(31(28)34-32)20-22-12-16-26(37-2)17-13-22/h4-6,9-10,12-20,30H,7-8,11,21H2,1-3H3,(H,33,34)/b24-20+InChIKey
DGTYRHRQWXGBHD-HIXSDJFHSA-NSynonyms
2(((8E)4(4methoxyphenyl)8((4methoxyphenyl)methylidene)4567tetrahydro1Hquinazolin2yl)sulfanyl)NmethylNphenylacetamide
2(((8E)8(4methoxybenzylidene)4(4methoxyphenyl)345678hexahydroquinazolin2yl)sulfanyl)NmethylNphenylacetamide
CN(C1=CC=CC=C1)C(=O)CSC2=NC(C3=C(N2)C(=CC4=CC=C(C=C4)OC)CCC3)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1NC(=NC2=C1CCCC2=Cc1ccc(cc1)OC)SCC(=O)N(c1ccccc1)C
InChI=1SC32H33N3O3Sc135(2595461025)29(36)2139323330(23141827(383)191523)28117824(31(28)3432)2022121626(372)171322h46910122030H781121H213H3(H3334)b2420+
MFCD03177095
ZINC000102901870
ZINC000102901873
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