Vitas-M small molecule compound

4-(acetylamino)-5-chloro-2-methoxy-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide

Catalog ID
STK263669
SMILES COc1cc(NC(=O)C)c(cc1C(=O)Nc1nnc(s1)CCCc1ccccc1)Cl

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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 C21H21ClN4O3S MW 444.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O3S/c1-13(27)23-17-12-18(29-2)15(11-16(17)22)20(28)24-21-26-25-19(30-21)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,23,27)(H,24,26,28)
InChIKey
SCFFAIQSJOQDFE-UHFFFAOYSA-N
Synonyms
893248-35-6
4(acetylamino)5chloro2methoxyN(5(3phenylpropyl)134thiadiazol2yl)benzamide
4acetamido5chloro2methoxyN(5(3phenylpropyl)134thiadiazol2yl)benzamide
893248356
CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2=NN=C(S2)CCCC3=CC=CC=C3)Cl
InChI=1SC21H21ClN4O3Sc113(27)23171218(292)15(1116(17)22)20(28)2421262519(3021)1069147435814h35781112H6910H212H3(H2327)(H242628)
MFCD07152724
N(2CHLORO5METHOXY4(N(5(3PHENYLPROPYL)(134THIADIAZOL2YL))CARBAMOYL)PHENYL)ACETAMIDE
ZINC000009489236
ZINC09489236
ZINC9489236

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Available files

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