Vitas-M small molecule compound
N-{1-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}-2-(1H-benzotriazol-1-yl)-N-benzylacetamide
Catalog ID
STL446919
SMILES COc1ccc(cc1)NC(=O)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1)c1ccc2c(c1)OCO2
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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 C31H27N5O5 MW 549.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O5/c1-39-24-14-12-23(13-15-24)32-31(38)30(22-11-16-27-28(17-22)41-20-40-27)35(18-21-7-3-2-4-8-21)29(37)19-36-26-10-6-5-9-25(26)33-34-36/h2-17,30H,18-20H2,1H3,(H,32,38)InChIKey
FWWAIEARRHIAIR-UHFFFAOYSA-NSynonyms
2(13BENZODIOXOL5YL)2((2(BENZOTRIAZOL1YL)ACETYL)BENZYLAMINO)N(4METHOXYPHENYL)ACETAMIDE
2(2(1HBENZO(D)(123)TRIAZOL1YL)NBENZYLACETAMIDO)2(BENZO(D)(13)DIOXOL5YL)N(4METHOXYPHENYL)ACETAMIDE
COC1=CC=C(C=C1)NC(=O)C(C2=CC3=C(C=C2)OCO3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC31H27N5O5c13924141223(131524)3231(38)30(2211162728(1722)41204027)35(18217324821)29(37)1936261065925(26)333436h21730H1820H21H3(H3238)
MFCD06244493
N(1(13benzodioxol5yl)2((4methoxyphenyl)amino)2oxoethyl)2(1Hbenzotriazol1yl)Nbenzylacetamide
ZINC000001419092
ZINC000001419093
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