Vitas-M small molecule compound
N-[(5-{[1-(cyclopentylamino)-1-oxopropan-2-yl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
Catalog ID
STL122587
SMILES Cc1cccc(c1)C(=O)NCc1nnc(n1C)SC(C(=O)NC1CCCC1)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 C20H27N5O2S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O2S/c1-13-7-6-8-15(11-13)19(27)21-12-17-23-24-20(25(17)3)28-14(2)18(26)22-16-9-4-5-10-16/h6-8,11,14,16H,4-5,9-10,12H2,1-3H3,(H,21,27)(H,22,26)InChIKey
BNFNJWWLJIZABH-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SC(C)C(=O)NC3CCCC3
InChI=1SC20H27N5O2Sc11376815(1113)19(27)211217232420(25(17)3)2814(2)18(26)22169451016h68111416H4591012H213H3(H2127)(H2226)
MFCD17011562
N((5((1(cyclopentylamino)1oxopropan2yl)sulfanyl)4methyl4H124triazol3yl)methyl)3methylbenzamide
N((5(1(cyclopentylamino)1oxopropan2yl)sulfanyl4methyl124triazol3yl)methyl)3methylbenzamide
ZINC000020164311
ZINC000020164312
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