Vitas-M small molecule compound

tert-butyl (3S)-3-[(4-methylpiperazin-1-yl)carbonyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate

Catalog ID
STK600384
SMILES CN1CCN(CC1)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(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 C20H29N3O3 MW 359.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O3/c1-20(2,3)26-19(25)23-14-16-8-6-5-7-15(16)13-17(23)18(24)22-11-9-21(4)10-12-22/h5-8,17H,9-14H2,1-4H3/t17-/m0/s1
InChIKey
SWAVBAKWHMVXME-KRWDZBQOSA-N
Synonyms
1173687-28-9
(S)tertbutyl3(4methylpiperazine1carbonyl)34dihydroisoquinoline2(1H)carboxylate
1173687289
CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCN(CC3)C
CN1CCN(CC1)C(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C
InChI=1SC20H29N3O3c120(23)2619(25)231416865715(16)1317(23)18(24)2211921(4)101222h5817H914H214H3t17m0s1
MFCD06780049
tertbutyl(3S)3((4methylpiperazin1yl)carbonyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3(4methylpiperazine1carbonyl)34dihydro1Hisoquinoline2carboxylate
ZINC000020547439
ZINC20547439

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Available files

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