Vitas-M small molecule compound
N-[1-(1H-benzimidazol-2-yl)ethyl]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL409238
SMILES CC(c1nc2c([nH]1)cccc2)NC(=O)c1c(C)nn(c1C)C1CCS(=O)(=O)C1
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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 C19H23N5O3S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5O3S/c1-11-17(13(3)24(23-11)14-8-9-28(26,27)10-14)19(25)20-12(2)18-21-15-6-4-5-7-16(15)22-18/h4-7,12,14H,8-10H2,1-3H3,(H,20,25)(H,21,22)InChIKey
MUSGGDXDSQCGME-UHFFFAOYSA-NSynonyms
C(C@@H)(c1nc2c((nH)1)cccc2)NC(=O)c1c(C)nn(c1C)C1CCS(=O)(=O)C1
CC(c1nc2c((nH)1)cccc2)NC(=O)c1c(C)nn(c1C)C1CCS(=O)(=O)C1
CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)C(=O)NC(C)C3=NC4=CC=CC=C4N3
InChI=1SC19H23N5O3Sc11117(13(3)24(2311)148928(2627)1014)19(25)2012(2)182115645716(15)2218h471214H810H213H3(H2025)(H2122)
MFCD30705618
N((S)1(1Hbenzo(d)imidazol2yl)ethyl)1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxamide
N(1(1Hbenzimidazol2yl)ethyl)1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxamide
N(1(1Hbenzimidazol2yl)ethyl)1(11dioxothiolan3yl)35dimethylpyrazole4carboxamide
ZINC000096118752
ZINC000206253852
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