Vitas-M small molecule compound

2-(1H-benzotriazol-1-yl)-N-(4-chlorobenzyl)-N-[2-{[4-(dimethylamino)phenyl]amino}-2-oxo-1-(thiophen-2-yl)ethyl]acetamide

Catalog ID
STL437641
SMILES Clc1ccc(cc1)CN(C(c1cccs1)C(=O)Nc1ccc(cc1)N(C)C)C(=O)Cn1nnc2c1cccc2

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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 C29H27ClN6O2S MW 559.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN6O2S/c1-34(2)23-15-13-22(14-16-23)31-29(38)28(26-8-5-17-39-26)35(18-20-9-11-21(30)12-10-20)27(37)19-36-25-7-4-3-6-24(25)32-33-36/h3-17,28H,18-19H2,1-2H3,(H,31,38)
InChIKey
SEUBNYPBCSXFPB-UHFFFAOYSA-N
Synonyms

2((2(benzotriazol1yl)acetyl)((4chlorophenyl)methyl)amino)N(4(dimethylamino)phenyl)2thiophen2ylacetamide
2((2(BENZOTRIAZOL1YL)ACETYL)((4CHLOROPHENYL)METHYL)AMINO)N(4DIMETHYLAMINOPHENYL)2THIOPHEN2YLACETAMIDE
2(1Hbenzotriazol1yl)N(4chlorobenzyl)N(2((4(dimethylamino)phenyl)amino)2oxo1(thiophen2yl)ethyl)acetamide
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(4CHLOROBENZYL)ACETAMIDO)N(4(DIMETHYLAMINO)PHENYL)2(THIOPHEN2YL)ACETAMIDE
CN(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=CS2)N(CC3=CC=C(C=C3)Cl)C(=O)CN4C5=CC=CC=C5N=N4
InChI=1SC29H27ClN6O2Sc134(2)23151322(141623)3129(38)28(2685173926)35(182091121(30)121020)27(37)193625743624(25)323336h31728H1819H212H3(H3138)
MFCD06244505
ZINC000001419188
ZINC000001419189

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Available files

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