Vitas-M small molecule compound
N-{6-tert-butyl-3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK444013
SMILES CCc1ccc(cc1)NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1ccnn1C
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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 C26H32N4O2S MW 464.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O2S/c1-6-16-7-10-18(11-8-16)28-24(32)22-19-12-9-17(26(2,3)4)15-21(19)33-25(22)29-23(31)20-13-14-27-30(20)5/h7-8,10-11,13-14,17H,6,9,12,15H2,1-5H3,(H,28,32)(H,29,31)InChIKey
HAZSBHAPKMXIDY-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=CC=NN4C
InChI=1SC26H32N4O2Sc161671018(11816)2824(32)221912917(26(23)4)1521(19)3325(22)2923(31)2013142730(20)5h781011131417H691215H215H3(H2832)(H2931)
MFCD04055208
N(6tertbutyl3((4ethylphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)1methyl1Hpyrazole5carboxamide
N(6tertbutyl3((4ethylphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)2methylpyrazole3carboxamide
ZINC000020192608
ZINC000020192611
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