Vitas-M small molecule compound
4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Catalog ID
STK569722
SMILES CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2cc(Cl)ccc2C)/s1)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 C21H28ClN5O2S MW 450.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28ClN5O2S/c1-14(2)12-19-24-25-21(30-19)23-18(28)6-7-20(29)27-10-8-26(9-11-27)17-13-16(22)5-4-15(17)3/h4-5,13-14H,6-12H2,1-3H3,(H,23,25,28)InChIKey
CFFVYMPUIVDEKC-UHFFFAOYSA-NSynonyms
714225-89-54(4(5chloro2methylphenyl)piperazin1yl)N((2Z)5(2methylpropyl)134thiadiazol2(3H)ylidene)4oxobutanamide
4(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)N(5(2METHYLPROPYL)134THIADIAZOL2YL)4OXOBUTANAMIDE
714225895
CC(Cc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)c2cc(Cl)ccc2C)s1)C
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)CC(C)C
InChI=1SC21H28ClN5O2Sc114(2)1219242521(3019)2318(28)6720(29)2710826(91127)171316(22)5415(17)3h451314H612H213H3(H232528)
MFCD05727827
ZINC000017207989
ZINC17207989
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