Vitas-M small molecule compound
(3S)-N-[(2R)-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}propan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK579776
SMILES O=C([C@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)Nc1ccc(cc1)C(C)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 C22H27N3O2 MW 365.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2/c1-14(2)16-8-10-19(11-9-16)25-21(26)15(3)24-22(27)20-12-17-6-4-5-7-18(17)13-23-20/h4-11,14-15,20,23H,12-13H2,1-3H3,(H,24,27)(H,25,26)/t15-,20+/m1/s1InChIKey
JRLRWHOUJPGDRJ-QRWLVFNGSA-NSynonyms
(3S)N((2R)1oxo1((4(propan2yl)phenyl)amino)propan2yl)1234tetrahydroisoquinoline3carboxamide
(3S)N((2R)1oxo1(4propan2ylanilino)propan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1((4isopropylphenyl)amino)1oxopropan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CC(C)C1=CC=C(C=C1)NC(=O)C(C)NC(=O)C2CC3=CC=CC=C3CN2
InChI=1SC22H27N3O2c114(2)1681019(11916)2521(26)15(3)2422(27)201217645718(17)132320h41114152023H1213H213H3(H2427)(H2526)t1520+m1s1
MFCD06781225
O=C((C@@H)(NC(=O)(C@H)1NCc2c(C1)cccc2)C)Nc1ccc(cc1)C(C)CCl
O=C((C@H)(NC(=O)(C@H)1NCc2c(C1)cccc2)C)Nc1ccc(cc1)C(C)C
ZINC000035374845
ZINC35374845
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