Vitas-M small molecule compound
2-[(4-cyclohexyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxopyrrolidin-1-yl)benzyl]acetamide
Catalog ID
STK665210
SMILES O=C(CSc1n[nH]c(=O)n1C1CCCCC1)NCc1ccc(cc1)N1CCCC1=O
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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 C21H27N5O3S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3S/c27-18(14-30-21-24-23-20(29)26(21)17-5-2-1-3-6-17)22-13-15-8-10-16(11-9-15)25-12-4-7-19(25)28/h8-11,17H,1-7,12-14H2,(H,22,27)(H,23,29)InChIKey
VHDBAUCPKZUFRN-UHFFFAOYSA-NSynonyms
2((4CYCLOHEXYL5OXO1H124TRIAZOL3YL)SULFANYL)N((4(2OXOPYRROLIDIN1YL)PHENYL)METHYL)ACETAMIDE
2((4cyclohexyl5oxo45dihydro1H124triazol3yl)sulfanyl)N(4(2oxopyrrolidin1yl)benzyl)acetamide
2(4CYCLOHEXYL5OXO(124TRIAZOLIN3YLTHIO))N((4(2OXOPYRROLIDINYL)PHENYL)METHYL)ACETAMIDE
C1CCC(CC1)N2C(=O)NN=C2SCC(=O)NCC3=CC=C(C=C3)N4CCCC4=O
InChI=1SC21H27N5O3Sc2718(143021242320(29)26(21)175213617)22131581016(11915)25124719(25)28h81117H171214H2(H2227)(H2329)
MFCD08142346
O=C(CSc1n(nH)c(=O)n1C1CCCCC1)NCc1ccc(cc1)N1CCCC1=O
ZINC000012429209
ZINC12429209
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