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Vitas-M small molecule compound

2-{[4-(4-tert-butylphenyl)-3-carbamoyl-5-methylthiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid

Catalog ID
STK332987
SMILES O=C(C1CCCCC1C(=O)O)Nc1sc(c(c1C(=O)N)c1ccc(cc1)C(C)(C)C)C

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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 C24H30N2O4S MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O4S/c1-13-18(14-9-11-15(12-10-14)24(2,3)4)19(20(25)27)22(31-13)26-21(28)16-7-5-6-8-17(16)23(29)30/h9-12,16-17H,5-8H2,1-4H3,(H2,25,27)(H,26,28)(H,29,30)
InChIKey
PWXIGFBSWXPZRS-UHFFFAOYSA-N
Synonyms
495396-00-4
2(((3(AMINOCARBONYL)4(4TERTBUTYLPHENYL)5METHYL2THIENYL)AMINO)CARBONYL)CYCLOHEXANECARBOXYLICACID
2(((4(4TERTBUTYLPHENYL)3CARBAMOYL5METHYL2THIOPHENYL)AMINO)OXOMETHYL)1CYCLOHEXANECARBOXYLICACID
2((3AMINOCARBONYL4(4TERTBUTYLPHENYL)5METHYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((4(4TERTBUTYLPHENYL)3CARBAMOYL5METHYL2THIENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
2((4(4TERTBUTYLPHENYL)3CARBAMOYL5METHYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((4(4tertbutylphenyl)3carbamoyl5methylthiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2(N(4(4(TERTBUTYL)PHENYL)3CARBAMOYL5METHYL2THIENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
495396004
CC1=C(C(=C(S1)NC(=O)C2CCCCC2C(=O)O)C(=O)N)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC24H30N2O4Sc11318(1491115(121014)24(23)4)19(20(25)27)22(3113)2621(28)16756817(16)23(29)30h9121617H58H214H3(H22527)(H2628)(H2930)
MFCD02244150
ZINC000004574482
ZINC000004574485

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Available files

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