Vitas-M small molecule compound

3-(3,4-dimethoxyphenyl)-3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(pyridin-3-ylmethyl)propanamide

Catalog ID
STK807797
SMILES COc1cc(ccc1OC)C(Sc1nnc([nH]1)c1ccc(cc1)OC)CC(=O)NCc1cccnc1

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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 C26H27N5O4S MW 505.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O4S/c1-33-20-9-6-18(7-10-20)25-29-26(31-30-25)36-23(19-8-11-21(34-2)22(13-19)35-3)14-24(32)28-16-17-5-4-12-27-15-17/h4-13,15,23H,14,16H2,1-3H3,(H,28,32)(H,29,30,31)
InChIKey
ITFBZEIIDRDYKZ-UHFFFAOYSA-N
Synonyms
838259-73-7
3(34DIMETHOXYPHENYL)3((5(4METHOXYPHENYL)1H124TRIAZOL3YL)SULFANYL)N(PYRIDIN3YLMETHYL)PROPANAMIDE
3(34dimethoxyphenyl)3((5(4methoxyphenyl)4H124triazol3yl)sulfanyl)N(pyridin3ylmethyl)propanamide
3(34DIMETHOXYPHENYL)3((5(4METHOXYPHENYL)4H124TRIAZOL3YL)THIO)N(PYRIDIN3YLMETHYL)PROPANAMIDE
3(34DIMETHOXYPHENYL)3(5(4METHOXYPHENYL)(4H124TRIAZOL3YLTHIO))N(3PYRIDYLMETHYL)PROPANAMIDE
838259737
COC1=CC=C(C=C1)C2=NC(=NN2)SC(CC(=O)NCC3=CN=CC=C3)C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)C(Sc1nnc((nH)1)c1ccc(cc1)OC)CC(=O)NCc1cccnc1
InChI=1SC26H27N5O4Sc133209618(71020)252926(313025)3623(1981121(342)22(1319)353)1424(32)2816175412271517h4131523H1416H213H3(H2832)(H293031)
MFCD05885209
ZINC000001069626
ZINC000001069629

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Available files

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