Vitas-M small molecule compound
6-({3-carbamoyl-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK428933
SMILES O=C(C1CC=CCC1C(=O)O)Nc1sc(c(c1C(=O)N)c1ccc(cc1)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 C23H26N2O4S MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4S/c1-12(2)14-8-10-15(11-9-14)18-13(3)30-22(19(18)20(24)26)25-21(27)16-6-4-5-7-17(16)23(28)29/h4-5,8-12,16-17H,6-7H2,1-3H3,(H2,24,26)(H,25,27)(H,28,29)InChIKey
GMKSXPJBBNBTPC-UHFFFAOYSA-NSynonyms
6((3carbamoyl5methyl4(4(propan2yl)phenyl)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3CARBAMOYL5METHYL4(4PROPAN2YLPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(3CARBAMOYL5METHYL4(4(METHYLETHYL)PHENYL)2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CC1=C(C(=C(S1)NC(=O)C2CC=CCC2C(=O)O)C(=O)N)C3=CC=C(C=C3)C(C)C
InChI=1SC23H26N2O4Sc112(2)1481015(11914)1813(3)3022(19(18)20(24)26)2521(27)16645717(16)23(28)29h458121617H67H213H3(H22426)(H2527)(H2829)
MFCD02612542
ZINC000002777186
ZINC000002777189
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