Vitas-M small molecule compound
4-({3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-4-oxobutanoic acid
Catalog ID
STK076116
SMILES O=C(Nc1sc2c(c1C(=O)Nc1ccc(cc1)Cl)CCCC2)CCC(=O)O
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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 C19H19ClN2O4S MW 406.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O4S/c20-11-5-7-12(8-6-11)21-18(26)17-13-3-1-2-4-14(13)27-19(17)22-15(23)9-10-16(24)25/h5-8H,1-4,9-10H2,(H,21,26)(H,22,23)(H,24,25)InChIKey
XKYNGZKYHVTNSW-UHFFFAOYSA-NSynonyms
4((3((4chlorophenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
C1CCC2=C(C1)C(=C(S2)NC(=O)CCC(=O)O)C(=O)NC3=CC=C(C=C3)Cl
InChI=1SC19H19ClN2O4Sc20115712(8611)2118(26)1713312414(13)2719(17)2215(23)91016(24)25h58H14910H2(H2126)(H2223)(H2425)
MFCD01926333
O=C(Nc1sc2c(c1C(=O)Nc1ccc(cc1)Cl)CCCC2)CCC(=O)O
STK076116
ZINC000000722401
ZINC722401
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