Vitas-M small molecule compound

N-(3-chloro-4-fluorophenyl)-5,6-dimethoxy-3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-1H-indene-2-carbothioamide

Catalog ID
STK262198
SMILES COc1cc2c(cc1OC)CC(=C2NCCc1c[nH]c2c1cc(OC)cc2)C(=S)Nc1ccc(c(c1)Cl)F

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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 C29H27ClFN3O3S MW 552.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClFN3O3S/c1-35-19-5-7-25-20(13-19)16(15-33-25)8-9-32-28-21-14-27(37-3)26(36-2)11-17(21)10-22(28)29(38)34-18-4-6-24(31)23(30)12-18/h4-7,11-15,32-33H,8-10H2,1-3H3,(H,34,38)
InChIKey
VTEIXCVYICQFNM-UHFFFAOYSA-N
Synonyms

(56DIMETHOXY3((2(5METHOXYINDOL3YL)ETHYL)AMINO)INDEN2YL)((3CHLORO4FLUOROPHENYL)AMINO)METHANE1THIONE
COC1=CC2=C(C=C1)NC=C2CCNC3=C(CC4=CC(=C(C=C43)OC)OC)C(=S)NC5=CC(=C(C=C5)F)Cl
COc1cc2c(cc1OC)CC(=C2NCCc1c(nH)c2c1cc(OC)cc2)C(=S)Nc1ccc(c(c1)Cl)F
InChI=1SC29H27ClFN3O3Sc13519572520(1319)16(153325)893228211427(373)26(362)1117(21)1022(28)29(38)34184624(31)23(30)1218h4711153233H810H213H3(H3438)
MFCD08547529
N(3chloro4fluorophenyl)56dimethoxy3((2(5methoxy1Hindol3yl)ethyl)amino)1Hindene2carbothioamide
N(3chloro4fluorophenyl)56dimethoxy3(2(5methoxy1Hindol3yl)ethylamino)1Hindene2carbothioamide
ZINC000100430931
ZINC100430931

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Available files

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