Vitas-M small molecule compound

3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]propanamide

Catalog ID
STL315150
SMILES O=C(Nc1[nH]nc(n1)C(C)C)CCc1c(C)n[nH]c1C

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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 C13H20N6O MW 276.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N6O/c1-7(2)12-15-13(19-18-12)14-11(20)6-5-10-8(3)16-17-9(10)4/h7H,5-6H2,1-4H3,(H,16,17)(H2,14,15,18,19,20)
InChIKey
NEHFZLPDBWCCAQ-UHFFFAOYSA-N
Synonyms
1441886-60-7
1441886607
3(35dimethyl1Hpyrazol4yl)N(3(propan2yl)1H124triazol5yl)propanamide
3(35dimethyl1Hpyrazol4yl)N(5isopropyl1H124triazol3yl)propanamide
3(35dimethyl1Hpyrazol4yl)N(5propan2yl1H124triazol3yl)propanamide
CC1=C(C(=NN1)C)CCC(=O)NC2=NNC(=N2)C(C)C
InChI=1SC13H20N6Oc17(2)121513(191812)1411(20)65108(3)16179(10)4h7H56H214H3(H1617)(H21415181920)
MFCD28027087
O=C(Nc1(nH)nc(n1)C(C)C)CCc1c(C)n(nH)c1C
O=C(Nc1n(nH)c(n1)C(C)C)CCc1c(C)n(nH)c1C
ZINC000095476856
ZINC95476856

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Available files

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