Vitas-M small molecule compound
3-[(3-{[(2E)-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]carbamoyl}phenyl)carbamoyl]pyrazine-2-carboxylic acid
Catalog ID
STL248185
SMILES O=C(c1cccc(c1)NC(=O)c1nccnc1C(=O)O)/N=c/1\[nH]c(c(s1)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 C18H15N5O4S MW 397.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O4S/c1-9-10(2)28-18(21-9)23-15(24)11-4-3-5-12(8-11)22-16(25)13-14(17(26)27)20-7-6-19-13/h3-8H,1-2H3,(H,22,25)(H,26,27)(H,21,23,24)InChIKey
XZXNMWAHOTUFOM-UHFFFAOYSA-NSynonyms
1351680-10-81351680108
3((3(((2E)45dimethyl13thiazol2(3H)ylidene)carbamoyl)phenyl)carbamoyl)pyrazine2carboxylicacid
3((3((45dimethyl13thiazol2yl)carbamoyl)phenyl)carbamoyl)pyrazine2carboxylicacid
CC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=NC=CN=C3C(=O)O)C
InChI=1SC18H15N5O4Sc1910(2)2818(219)2315(24)1143512(811)2216(25)1314(17(26)27)20761913h38H12H3(H2225)(H2627)(H212324)
MFCD24861126
O=C(c1cccc(c1)NC(=O)c1nccnc1C(=O)O)N=c1(nH)c(c(s1)C)C
ZINC000072400659
ZINC72400659
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