Vitas-M small molecule compound
methyl 2-{[({5-[(3-phenylpropanoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK092718
SMILES COC(=O)c1ccccc1NC(=O)CSc1nnc(s1)NC(=O)CCc1ccccc1
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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 C21H20N4O4S2 MW 456.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S2/c1-29-19(28)15-9-5-6-10-16(15)22-18(27)13-30-21-25-24-20(31-21)23-17(26)12-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,22,27)(H,23,24,26)InChIKey
BLEIQENZVNSWMV-UHFFFAOYSA-NSynonyms
533919-07-2COC(=O)C1=CC=CC=C1NC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3
COC(=O)c1ccccc1NC(=O)CSc1nnc(s1)NC(=O)CCc1ccccc1
InChI=1SC21H20N4O4S2c12919(28)159561016(15)2218(27)133021252420(3121)2317(26)1211147324814h210H1113H21H3(H2227)(H232426)
METHYL2(((((5Z)5((3PHENYLPROPANOYL)IMINO)45DIHYDRO134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL2((((5((3PHENYLPROPANOYL)AMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL2((2((5(3PHENYLPROPANOYLAMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl2(2((5(3phenylpropanamido)134thiadiazol2yl)thio)acetamido)benzoate
MFCD03356300
STK092718
ZINC09316722
ZINC9316722
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