Vitas-M small molecule compound
5-[(2S)-1-benzylpyrrolidin-2-yl]-4-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK684180
SMILES Clc1ccc(cc1)n1c(S)nnc1[C@@H]1CCCN1Cc1ccccc1
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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 C19H19ClN4S MW 370.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN4S/c20-15-8-10-16(11-9-15)24-18(21-22-19(24)25)17-7-4-12-23(17)13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13H2,(H,22,25)/t17-/m0/s1InChIKey
NUBGPENOHGDBHU-KRWDZBQOSA-NSynonyms
3((2S)1BENZYLPYRROLIDIN2YL)4(4CHLOROPHENYL)1H124TRIAZOLE5THIONE
5((2S)1benzylpyrrolidin1ium2yl)4(4chlorophenyl)124triazole3thiolate
5((2S)1benzylpyrrolidin2yl)4(4chlorophenyl)4H124triazole3thiol
C1CC((NH+)(C1)CC2=CC=CC=C2)C3=NN=C(N3C4=CC=C(C=C4)Cl)(S)
Clc1ccc(cc1)n1c(S)nnc1(C@@H)1CCCN1Cc1ccccc1
InChI=1SC19H19ClN4Sc201581016(11915)2418(212219(24)25)17741223(17)13145213614h135681117H471213H2(H2225)t17m0s1
MFCD18246921
ZINC000019858296
ZINC19858296
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