Vitas-M small molecule compound
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-2-(1H-tetrazol-1-yl)acetamide
Catalog ID
STL252483
SMILES O=C(C(n1cnnn1)c1ccccc1)Nc1ccc2c(c1)OCCCO2
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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 C18H17N5O3 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O3/c24-18(17(23-12-19-21-22-23)13-5-2-1-3-6-13)20-14-7-8-15-16(11-14)26-10-4-9-25-15/h1-3,5-8,11-12,17H,4,9-10H2,(H,20,24)InChIKey
GCCSCGDQHOGEGX-UHFFFAOYSA-NSynonyms
(S)N(34dihydro2Hbenzo(b)(14)dioxepin7yl)2phenyl2(1Htetrazol1yl)acetamide
C1COC2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)N4C=NN=N4)OC1
InChI=1SC18H17N5O3c2418(17(231219212223)135213613)2014781516(1114)2610492515h1358111217H4910H2(H2024)
MFCD24852984
N(34dihydro2H15benzodioxepin7yl)2phenyl2(1Htetrazol1yl)acetamide
N(34dihydro2H15benzodioxepin7yl)2phenyl2(tetrazol1yl)acetamide
O=C((C@@H)(n1cnnn1)c1ccccc1)Nc1ccc2c(c1)OCCCO2
ZINC000072403069
ZINC000080338614
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