Vitas-M small molecule compound
N-{6-tert-butyl-3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK444020
SMILES CCOc1ccccc1NC(=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 C26H32N4O3S MW 480.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O3S/c1-6-33-20-10-8-7-9-18(20)28-24(32)22-17-12-11-16(26(2,3)4)15-21(17)34-25(22)29-23(31)19-13-14-27-30(19)5/h7-10,13-14,16H,6,11-12,15H2,1-5H3,(H,28,32)(H,29,31)InChIKey
KLXWKTIAJHZXGD-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=CC=NN4C
InChI=1SC26H32N4O3Sc1633201087918(20)2824(32)2217121116(26(23)4)1521(17)3425(22)2923(31)1913142730(19)5h710131416H6111215H215H3(H2832)(H2931)
MFCD04055215
N(6tertbutyl3((2ethoxyphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)1methyl1Hpyrazole5carboxamide
N(6tertbutyl3((2ethoxyphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)2methylpyrazole3carboxamide
ZINC000020190253
ZINC000020190254
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