Vitas-M small molecule compound
3-[(3-chlorophenyl)amino]-2-{[(3-chlorophenyl)carbamothioyl]amino}-2-cyano-3-thioxopropanamide
Catalog ID
STL175794
SMILES N#CC(C(=S)Nc1cccc(c1)Cl)(C(=O)N)NC(=S)Nc1cccc(c1)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 C17H13Cl2N5OS2 MW 438.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2N5OS2/c18-10-3-1-5-12(7-10)22-15(26)17(9-20,14(21)25)24-16(27)23-13-6-2-4-11(19)8-13/h1-8H,(H2,21,25)(H,22,26)(H2,23,24,27)InChIKey
PQOHOMWOTOOMJM-UHFFFAOYSA-NSynonyms
938015-68-03((3chlorophenyl)amino)2(((3chlorophenyl)carbamothioyl)amino)2cyano3thioxopropanamide
3(3chloroanilino)2((3chlorophenyl)carbamothioylamino)2cyano3sulfanylidenepropanamide
938015680
C1=CC(=CC(=C1)Cl)NC(=S)C(C#N)(C(=O)N)NC(=S)NC2=CC(=CC=C2)Cl
InChI=1SC17H13Cl2N5OS2c181031512(710)2215(26)17(92014(21)25)2416(27)231362411(19)813h18H(H22125)(H2226)(H2232427)
MFCD08556532
ZINC000036615016
ZINC000036615017
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