Vitas-M small molecule compound
N-(4-ethoxyphenyl)-2-({5-[(naphthalen-1-ylamino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STL172414
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)CNc1cccc2c1cccc2
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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 C29H27N5O2S MW 509.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O2S/c1-2-36-24-17-15-22(16-18-24)31-28(35)20-37-29-33-32-27(34(29)23-11-4-3-5-12-23)19-30-26-14-8-10-21-9-6-7-13-25(21)26/h3-18,30H,2,19-20H2,1H3,(H,31,35)InChIKey
BWJZMYBCSWOWML-UHFFFAOYSA-NSynonyms
768375-61-7768375617
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=CC5=CC=CC=C54
InChI=1SC29H27N5O2Sc123624171522(161824)3128(35)203729333227(34(29)23114351223)19302614810219671325(21)26h31830H21920H21H3(H3135)
MFCD01430925
N(4ethoxyphenyl)2((5((naphthalen1ylamino)methyl)4phenyl124triazol3yl)sulfanyl)acetamide
N(4ethoxyphenyl)2((5((naphthalen1ylamino)methyl)4phenyl4H124triazol3yl)sulfanyl)acetamide
ZINC000002738846
ZINC02738846
ZINC2738846
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