Vitas-M small molecule compound
N-{4-[5-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-4-benzyl-4H-1,2,4-triazol-3-yl]phenyl}propanamide
Catalog ID
STK138866
SMILES CCC(=O)Nc1ccc(cc1)c1nnc(n1Cc1ccccc1)SCC(=O)Nc1ccc(cc1)C(=O)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 C28H27N5O3S MW 513.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O3S/c1-3-25(35)29-23-15-11-22(12-16-23)27-31-32-28(33(27)17-20-7-5-4-6-8-20)37-18-26(36)30-24-13-9-21(10-14-24)19(2)34/h4-16H,3,17-18H2,1-2H3,(H,29,35)(H,30,36)InChIKey
YPCQVSPCTZNBHQ-UHFFFAOYSA-NSynonyms
CCC(=O)NC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)C(=O)C
InChI=1SC28H27N5O3Sc1325(35)2923151122(121623)27313228(33(27)17207546820)371826(36)302413921(101424)19(2)34h416H31718H212H3(H2935)(H3036)
MFCD04153238
N(4(5((2((4ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4BENZYL4H124TRIAZOL3YL)PHENYL)PROPANAMIDE
N(4(5((2(4ACETYLANILINO)2OXOETHYL)SULFANYL)4BENZYL4H124TRIAZOL3YL)PHENYL)PROPANAMIDE
N(4(5(2(4ACETYLANILINO)2OXOETHYL)SULFANYL4BENZYL124TRIAZOL3YL)PHENYL)PROPANAMIDE
ZINC000000624649
ZINC00624649
ZINC624649
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