Vitas-M small molecule compound

2-(1H-benzotriazol-1-yl)-N-[1-(3,4-dimethoxyphenyl)-2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl]-N-(4-fluorobenzyl)acetamide

Catalog ID
STL446818
SMILES COc1ccc(cc1OC)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccc(cc1)F)C(=O)Nc1ccc(cc1)N(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 C33H33FN6O4 MW 596.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33FN6O4/c1-38(2)26-16-14-25(15-17-26)35-33(42)32(23-11-18-29(43-3)30(19-23)44-4)39(20-22-9-12-24(34)13-10-22)31(41)21-40-28-8-6-5-7-27(28)36-37-40/h5-19,32H,20-21H2,1-4H3,(H,35,42)
InChIKey
CTNVKILPTKUZNA-UHFFFAOYSA-N
Synonyms

2((2(benzotriazol1yl)acetyl)((4fluorophenyl)methyl)amino)2(34dimethoxyphenyl)N(4(dimethylamino)phenyl)acetamide
2((2(BENZOTRIAZOL1YL)ACETYL)((4FLUOROPHENYL)METHYL)AMINO)2(34DIMETHOXYPHENYL)N(4DIMETHYLAMINOPHENYL)ACETAMIDE
2(1Hbenzotriazol1yl)N(1(34dimethoxyphenyl)2((4(dimethylamino)phenyl)amino)2oxoethyl)N(4fluorobenzyl)acetamide
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(4FLUOROBENZYL)ACETAMIDO)2(34DIMETHOXYPHENYL)N(4(DIMETHYLAMINO)PHENYL)ACETAMIDE
CN(C)C1=CC=C(C=C1)NC(=O)C(C2=CC(=C(C=C2)OC)OC)N(CC3=CC=C(C=C3)F)C(=O)CN4C5=CC=CC=C5N=N4
InChI=1SC33H33FN6O4c138(2)26161425(151726)3533(42)32(23111829(433)30(1923)444)39(202291224(34)131022)31(41)214028865727(28)363740h51932H2021H214H3(H3542)
MFCD06244425
ZINC000008695789
ZINC000008695790
ZINC08695790

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Available files

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