Vitas-M small molecule compound
N-[1-(5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-2-methylpropyl]benzamide
Catalog ID
STK230412
SMILES O=C(NC1CCCC1)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccccc1
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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/c1-14(2)18(23-20(28)15-9-5-4-6-10-15)19-24-25-21(26(19)3)29-13-17(27)22-16-11-7-8-12-16/h4-6,9-10,14,16,18H,7-8,11-13H2,1-3H3,(H,22,27)(H,23,28)InChIKey
FJLBENRVRYCBFJ-UHFFFAOYSA-NSynonyms
CC(C)C(C1=NN=C(N1C)SCC(=O)NC2CCCC2)NC(=O)C3=CC=CC=C3
InChI=1SC21H29N5O2Sc114(2)18(2320(28)1595461015)19242521(26(19)3)291317(27)221611781216h46910141618H781113H213H3(H2227)(H2328)
MFCD07790460
N(1(5((2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2METHYLPROPYL)BENZAMIDE
N(1(5(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)2METHYLPROPYL)BENZAMIDE
N(1(5CYCLOPENTYLCARBAMOYLMETHYLSULFANYL4METHYL4H(124)TRIAZOL3YL)2METHYLPROPYL)BENZAMIDE
ZINC000004735976
ZINC000004735977
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