Vitas-M small molecule compound
4-(1H-indol-3-ylcarbonyl)-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(phenylamino)butan-2-yl]piperazine-1-carboxamide
Catalog ID
STK624946
SMILES CSCC[C@@H](C(=O)Nc1ccccc1)NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2
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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 C25H29N5O3S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3S/c1-34-16-11-22(23(31)27-18-7-3-2-4-8-18)28-25(33)30-14-12-29(13-15-30)24(32)20-17-26-21-10-6-5-9-19(20)21/h2-10,17,22,26H,11-16H2,1H3,(H,27,31)(H,28,33)/t22-/m0/s1InChIKey
SDIXSCMJWDVSRD-QFIPXVFZSA-NSynonyms
1013754-66-9(S)4(1Hindole3carbonyl)N(4(methylthio)1oxo1(phenylamino)butan2yl)piperazine1carboxamide
1013754669
4(1Hindol3ylcarbonyl)N((2S)4(methylsulfanyl)1oxo1(phenylamino)butan2yl)piperazine1carboxamide
CSCC(C@@H)(C(=O)Nc1ccccc1)NC(=O)N1CCN(CC1)C(=O)c1c(nH)c2c1cccc2
CSCCC(C(=O)NC1=CC=CC=C1)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43
InChI=1SC25H29N5O3Sc134161122(23(31)27187324818)2825(33)30141229(131530)24(32)201726211065919(20)21h210172226H1116H21H3(H2731)(H2833)t22m0s1
MFCD09849019
N((2S)1anilino4methylsulfanyl1oxobutan2yl)4(1Hindole3carbonyl)piperazine1carboxamide
ZINC000009050638
ZINC09050638
ZINC9050638
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