Vitas-M small molecule compound
(3S)-N-[(2S)-1-(cyclopentylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK573988
SMILES CSCC[C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2
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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 C20H29N3O2S MW 375.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O2S/c1-26-11-10-17(19(24)22-16-8-4-5-9-16)23-20(25)18-12-14-6-2-3-7-15(14)13-21-18/h2-3,6-7,16-18,21H,4-5,8-13H2,1H3,(H,22,24)(H,23,25)/t17-,18-/m0/s1InChIKey
GQMHXRIGSZZYGH-ROUUACIJSA-NSynonyms
(3S)N((2S)1(cyclopentylamino)4(methylsulfanyl)1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(3S)N((2S)1(cyclopentylamino)4methylsulfanyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1(cyclopentylamino)4(methylthio)1oxobutan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CSCC(C@@H)(C(=O)NC1CCCC1)NC(=O)(C@H)1NCc2c(C1)cccc2
CSCC(C@@H)(C(=O)NC1CCCC1)NC(=O)(C@H)1NCc2c(C1)cccc2Cl
CSCCC(C(=O)NC1CCCC1)NC(=O)C2CC3=CC=CC=C3CN2
InChI=1SC20H29N3O2Sc126111017(19(24)2216845916)2320(25)181214623715(14)132118h2367161821H45813H21H3(H2224)(H2325)t1718m0s1
MFCD06783218
ZINC000035380463
ZINC35380463
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