Vitas-M small molecule compound
N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-propoxybenzamide
Catalog ID
STK080192
SMILES CCCOc1cccc(c1)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-4-12-32-20-7-5-6-18(14-20)24(31)27-25(33)26-21-15-23-22(13-17(21)3)28-30(29-23)19-10-8-16(2)9-11-19/h5-11,13-15H,4,12H2,1-3H3,(H2,26,27,31,33)InChIKey
DQZJNVIJFMUQAI-UHFFFAOYSA-NSynonyms
CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2C)C4=CC=C(C=C4)C
CCCOc1cccc(c1)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)C
InChI=1SC25H25N5O2Sc1412322075618(1420)24(31)2725(33)2621152322(1317(21)3)2830(2923)1910816(2)91119h5111315H412H213H3(H226273133)
MFCD02630398
N((6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)3PROPOXYBENZAMIDE
N((6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)3PROPOXYBENZAMIDE
STK080192
ZINC000002985079
ZINC02985079
ZINC2985079
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