Vitas-M small molecule compound
N-{6-tert-butyl-3-[(2,4-dimethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK444015
SMILES COc1cc(OC)ccc1NC(=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 C26H32N4O4S MW 496.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O4S/c1-26(2,3)15-7-9-17-21(13-15)35-25(29-23(31)19-11-12-27-30(19)4)22(17)24(32)28-18-10-8-16(33-5)14-20(18)34-6/h8,10-12,14-15H,7,9,13H2,1-6H3,(H,28,32)(H,29,31)InChIKey
AZXVNMRJHJCGJL-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=C(C=C3)OC)OC)NC(=O)C4=CC=NN4C
InChI=1SC26H32N4O4Sc126(23)15791721(1315)3525(2923(31)1911122730(19)4)22(17)24(32)281810816(335)1420(18)346h810121415H7913H216H3(H2832)(H2931)
MFCD04055210
N(6tertbutyl3((24dimethoxyphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)1methyl1Hpyrazole5carboxamide
N(6tertbutyl3((24dimethoxyphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)2methylpyrazole3carboxamide
ZINC000020467893
ZINC000020467894
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