Vitas-M small molecule compound
3,4,5-triethoxy-N-{[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK184606
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2
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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 C31H29N3O5S MW 555.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O5S/c1-4-36-26-16-20(17-27(37-5-2)28(26)38-6-3)29(35)34-31(40)32-21-14-15-25-24(18-21)33-30(39-25)23-13-9-11-19-10-7-8-12-22(19)23/h7-18H,4-6H2,1-3H3,(H2,32,34,35,40)InChIKey
SVJQHNISWUQZBY-UHFFFAOYSA-NSynonyms
345TRIETHOXYN((2(NAPHTHALEN1YL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
345TRIETHOXYN((2NAPHTHALEN1YL13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC5=CC=CC=C54
InChI=1SC31H29N3O5Sc1436261620(1727(3752)28(26)3863)29(35)3431(40)322114152524(1821)3330(3925)23139111910781222(19)23h718H46H213H3(H232343540)
MFCD03549060
N(((2NAPHTHYLBENZOXAZOL5YL)AMINO)THIOXOMETHYL)(345TRIETHOXYPHENYL)CARBOXAMIDE
ZINC000100316037
ZINC100316037
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