Vitas-M small molecule compound
4-(4-benzylpiperazin-1-yl)-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Catalog ID
STK569968
SMILES CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccccc2)/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 C21H29N5O2S MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O2S/c1-16(2)14-19-23-24-21(29-19)22-18(27)8-9-20(28)26-12-10-25(11-13-26)15-17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3,(H,22,24,27)InChIKey
RABRCLXTJAVFCS-UHFFFAOYSA-NSynonyms
714248-37-04(4benzylpiperazin1yl)N((2Z)5(2methylpropyl)134thiadiazol2(3H)ylidene)4oxobutanamide
4(4BENZYLPIPERAZIN1YL)N(5(2METHYLPROPYL)134THIADIAZOL2YL)4OXOBUTANAMIDE
714248370
CC(C)CC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3
CC(Cc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)Cc2ccccc2)s1)C
InChI=1SC21H29N5O2Sc116(2)1419232421(2919)2218(27)8920(28)26121025(111326)15176435717h3716H815H212H3(H222427)
MFCD05731536
ZINC000020442201
ZINC20442201
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