Vitas-M small molecule compound
propan-2-yl 5-carbamoyl-4-methyl-2-({N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]glycyl}amino)thiophene-3-carboxylate
Catalog ID
STK458779
SMILES CC(OC(=O)c1c(NC(=O)CN(Cc2c(C)nn(c2C)C)C)sc(c1C)C(=O)N)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 C20H29N5O4S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N5O4S/c1-10(2)29-20(28)16-11(3)17(18(21)27)30-19(16)22-15(26)9-24(6)8-14-12(4)23-25(7)13(14)5/h10H,8-9H2,1-7H3,(H2,21,27)(H,22,26)InChIKey
XKDIDOJALUZRNC-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN(C)CC2=C(N(N=C2C)C)C)C(=O)N
InChI=1SC20H29N5O4Sc110(2)2920(28)1611(3)17(18(21)27)3019(16)2215(26)924(6)81412(4)2325(7)13(14)5h10H89H217H3(H22127)(H2226)
METHYLETHYL5CARBAMOYL4METHYL2(2(METHYL((135TRIMETHYLPYRAZOL4YL)METHYL)AMINO)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06052350
propan2yl5carbamoyl4methyl2((2(methyl((135trimethylpyrazol4yl)methyl)amino)acetyl)amino)thiophene3carboxylate
propan2yl5carbamoyl4methyl2((NmethylN((135trimethyl1Hpyrazol4yl)methyl)glycyl)amino)thiophene3carboxylate
ZINC000017099645
ZINC17099645
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