Vitas-M small molecule compound
5-{2-[4-(propan-2-yloxy)phenyl]ethyl}-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL044044
SMILES C=CCn1c(CCc2ccc(cc2)OC(C)C)n[nH]c1=S
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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 C16H21N3OS MW 303.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3OS/c1-4-11-19-15(17-18-16(19)21)10-7-13-5-8-14(9-6-13)20-12(2)3/h4-6,8-9,12H,1,7,10-11H2,2-3H3,(H,18,21)InChIKey
QEYIREPIRMQCDM-UHFFFAOYSA-NSynonyms
510723-39-43(2(4PROPAN2YLOXYPHENYL)ETHYL)4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5(2(4ISOPROPOXYPHENYL)ETHYL)4H(124)TRIAZOLE3THIOL
4ALLYL5(2(4ISOPROPOXYPHENYL)ETHYL)4H124TRIAZOLE3THIOL
5(2(4(propan2yloxy)phenyl)ethyl)4(prop2en1yl)24dihydro3H124triazole3thione
510723394
C=CCn1c(CCc2ccc(cc2)OC(C)C)n(nH)c1=S
CC(C)OC1=CC=C(C=C1)CCC2=NNC(=S)N2CC=C
InChI=1SC16H21N3OSc14111915(171816(19)21)107135814(9613)2012(2)3h468912H171011H223H3(H1821)
MFCD03810758
ZINC01247425
ZINC1247425
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