Vitas-M small molecule compound
N-{6-tert-butyl-3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-chloro-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK445516
SMILES CCc1ccc(cc1)NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1c(Cl)cnn1C
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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 C26H31ClN4O2S MW 499.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClN4O2S/c1-6-15-7-10-17(11-8-15)29-23(32)21-18-12-9-16(26(2,3)4)13-20(18)34-25(21)30-24(33)22-19(27)14-28-31(22)5/h7-8,10-11,14,16H,6,9,12-13H2,1-5H3,(H,29,32)(H,30,33)InChIKey
NXZNOVGLRYZMOT-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=C(C=NN4C)Cl
InChI=1SC26H31ClN4O2Sc161571017(11815)2923(32)211812916(26(23)4)1320(18)3425(21)3024(33)2219(27)142831(22)5h7810111416H691213H215H3(H2932)(H3033)
MFCD04058194
N(6tertbutyl3((4ethylphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)4chloro1methyl1Hpyrazole5carboxamide
N(6tertbutyl3((4ethylphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)4chloro2methylpyrazole3carboxamide
ZINC000020192596
ZINC000020192600
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