Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-methyl-N-(thiophen-2-ylmethyl)heptan-1-amine
Catalog ID
STK585520
SMILES CC(CCC(c1ccc2c(c1)OCO2)CCNCc1cccs1)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 C20H27NO2S MW 345.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO2S/c1-15(2)5-6-16(9-10-21-13-18-4-3-11-24-18)17-7-8-19-20(12-17)23-14-22-19/h3-4,7-8,11-12,15-16,21H,5-6,9-10,13-14H2,1-2H3InChIKey
IIJOWOYOXBSRCU-UHFFFAOYSA-NSynonyms
(3R)3(13BENZODIOXOL5YL)6METHYLN(THIOPHEN2YLMETHYL)HEPTAN1AMINE
(3S)3(13BENZODIOXOL5YL)6METHYLN(THIOPHEN2YLMETHYL)HEPTAN1AMINE
3(13benzodioxol5yl)6methylN(thiophen2ylmethyl)heptan1amine
CC(C)CCC(CCNCC1=CC=CS1)C2=CC3=C(C=C2)OCO3
InChI=1SC20H27NO2Sc115(2)5616(91021131843112418)17781920(1217)23142219h34781112151621H569101314H212H3
MFCD06597307
ZINC000002208390
ZINC000002208391
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