Vitas-M small molecule compound
N-[(5-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide
Catalog ID
STK139526
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1c1ccccc1)SCC(=O)NCc1ccccc1
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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 C26H25N5O3S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O3S/c1-34-22-14-12-20(13-15-22)25(33)28-17-23-29-30-26(31(23)21-10-6-3-7-11-21)35-18-24(32)27-16-19-8-4-2-5-9-19/h2-15H,16-18H2,1H3,(H,27,32)(H,28,33)InChIKey
MXGOMDYZTQENHF-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4
InChI=1SC26H25N5O3Sc13422141220(131522)25(33)281723293026(31(23)21106371121)351824(32)2716198425919h215H1618H21H3(H2732)(H2833)
MFCD04376610
N((5((2(BENZYLAMINO)2OXOETHYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N((5(2(BENZYLAMINO)2OXOETHYL)SULFANYL4PHENYL124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N(5(BENZYLCARBAMOYLMETHYLSULFANYL)4PHENYL4H(124)TRIAZOL3YLMETHYL)4METHOXYBENZAMIDE
ZINC000001118973
ZINC01118973
ZINC1118973
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