Vitas-M small molecule compound

2-{[N-(3,4-dimethylphenyl)-N-(methylsulfonyl)alanyl]amino}-N-(propan-2-yl)benzamide

Catalog ID
STL087303
SMILES CC(NC(=O)c1ccccc1NC(=O)C(N(S(=O)(=O)C)c1ccc(c(c1)C)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 C22H29N3O4S MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O4S/c1-14(2)23-22(27)19-9-7-8-10-20(19)24-21(26)17(5)25(30(6,28)29)18-12-11-15(3)16(4)13-18/h7-14,17H,1-6H3,(H,23,27)(H,24,26)
InChIKey
BIMKNTXKLMNKPO-UHFFFAOYSA-N
Synonyms

2((N(34dimethylphenyl)N(methylsulfonyl)alanyl)amino)N(propan2yl)benzamide
2((N(34DIMETHYLPHENYL)N(METHYLSULFONYL)DALANYL)AMINO)N(PROPAN2YL)BENZAMIDE
2(2(34DIMETHYLNMETHYLSULFONYLANILINO)PROPANOYLAMINO)NPROPAN2YLBENZAMIDE
CC1=C(C=C(C=C1)N(C(C)C(=O)NC2=CC=CC=C2C(=O)NC(C)C)S(=O)(=O)C)C
InChI=1SC22H29N3O4Sc114(2)2322(27)199781020(19)2421(26)17(5)25(30(628)29)18121115(3)16(4)1318h71417H16H3(H2327)(H2426)
MFCD05836411
ZINC000002879755
ZINC000002879756

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Available files

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