Vitas-M small molecule compound
N-[(5-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-4-chlorobenzamide
Catalog ID
STK211499
SMILES O=C(NCc1ccccc1)CSc1nnc(n1c1ccccc1)CNC(=O)c1ccc(cc1)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 C25H22ClN5O2S MW 492.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2S/c26-20-13-11-19(12-14-20)24(33)28-16-22-29-30-25(31(22)21-9-5-2-6-10-21)34-17-23(32)27-15-18-7-3-1-4-8-18/h1-14H,15-17H2,(H,27,32)(H,28,33)InChIKey
PHWHGXQTCJQQHU-UHFFFAOYSA-NSynonyms
C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC=C(C=C4)Cl
InChI=1SC25H22ClN5O2Sc2620131119(121420)24(33)281622293025(31(22)2195261021)341723(32)2715187314818h114H1517H2(H2732)(H2833)
MFCD04405713
N((5((2(BENZYLAMINO)2OXOETHYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)METHYL)4CHLOROBENZAMIDE
N((5(2(benzylamino)2oxoethyl)sulfanyl4phenyl124triazol3yl)methyl)4chlorobenzamide
N(5(BENZYLCARBAMOYLMETHYLSULFANYL)4PHENYL4H(124)TRIAZOL3YLMETHYL)4CHLOROBENZAMIDE
ZINC000009261088
ZINC09261088
ZINC9261088
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