Vitas-M small molecule compound

Catalog ID
STK599115
SMILES COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1C)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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-12-9-13(2)20-17(10-12)23(22(29)25-20)18(11-19(26-23)14(3)27)21(28)24-15-5-7-16(30-4)8-6-15/h5-10,14,18-19,26-27H,11H2,1-4H3,(H,24,28)(H,25,29)/t14?,18-,19-,23+/m1/s1
InChIKey
HJLVOEMTJPHODK-HNSHIVHESA-N
Synonyms
1214626-16-0
(2R3S5R)5((R)1hydroxyethyl)N(4methoxyphenyl)57dimethyl2oxospiro(indoline32pyrrolidine)3carboxamide
(3R3S5R)5(1hydroxyethyl)N(4methoxyphenyl)57dimethyl2oxospiro(1Hindole32pyrrolidine)3carboxamide
1214626160
CC1=CC(=C2C(=C1)C3(C(CC(N3)C(C)O)C(=O)NC4=CC=C(C=C4)OC)C(=O)N2)C
COc1ccc(cc1)NC(=O)(C@H)1C(C@@H)(N(C@@)21C(=O)Nc1c2cc(C)cc1C)C(O)C
InChI=1SC23H27N3O4c112913(2)2017(1012)23(22(29)2520)18(1119(2623)14(3)27)21(28)24155716(304)8615h5101418192627H11H214H3(H2428)(H2529)t14?181923+m1s1
MFCD10488303
ZINC000005483829
ZINC000013592113

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.