Vitas-M small molecule compound
N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STK617902
SMILES COc1ccc(cc1)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)N[C@H](C(=O)NC1CCCC1)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 C27H35N3O5 MW 481.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O5/c1-17(26(31)29-20-7-5-6-8-20)28-27(32)30-14-13-19-15-23(34-3)24(35-4)16-22(19)25(30)18-9-11-21(33-2)12-10-18/h9-12,15-17,20,25H,5-8,13-14H2,1-4H3,(H,28,32)(H,29,31)/t17-,25?/m0/s1InChIKey
IKYMAIDVNQOQMX-LFUZPPSTSA-NSynonyms
CC(C(=O)NC1CCCC1)NC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=C(C=C4)OC)OC)OC
COc1ccc(cc1)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)N(C@H)(C(=O)NC1CCCC1)C
InChI=1SC27H35N3O5c117(26(31)2920756820)2827(32)301413191523(343)24(354)1622(19)25(30)1891121(332)121018h91215172025H581314H214H3(H2832)(H2931)t1725?m0s1
MFCD10488714
N((2S)1(cyclopentylamino)1oxopropan2yl)67dimethoxy1(4methoxyphenyl)34dihydro1Hisoquinoline2carboxamide
N((2S)1(cyclopentylamino)1oxopropan2yl)67dimethoxy1(4methoxyphenyl)34dihydroisoquinoline2(1H)carboxamide
N((S)1(cyclopentylamino)1oxopropan2yl)67dimethoxy1(4methoxyphenyl)34dihydroisoquinoline2(1H)carboxamide
ZINC000009304549
ZINC000009304552
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