Vitas-M small molecule compound
2-(3-{(E)-[1-(2,3-dichlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetamide
Catalog ID
STL376477
SMILES NC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
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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 C21H14Cl2N4O3S MW 473.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14Cl2N4O3S/c22-14-5-3-7-16(18(14)23)27-20(30)13(19(29)25-21(27)31)8-11-9-26(10-17(24)28)15-6-2-1-4-12(11)15/h1-9H,10H2,(H2,24,28)(H,25,29,31)/b13-8+InChIKey
SQCLDDMZZPGKJR-MDWZMJQESA-NSynonyms
2(3((E)(1(23dichlorophenyl)46dioxo2sulfanylidene13diazinan5ylidene)methyl)indol1yl)acetamide
2(3((E)(1(23dichlorophenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)acetamide
C1=CC=C2C(=C1)C(=CN2CC(=O)N)C=C3C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)Cl
InChI=1SC21H14Cl2N4O3Sc221453716(18(14)23)2720(30)13(19(29)2521(27)31)811926(1017(24)28)15621412(11)15h19H10H2(H22428)(H252931)b138+
MFCD28951135
NC(=O)Cn1cc(c2c1cccc2)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
ZINC000033316932
ZINC33316932
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