Vitas-M small molecule compound

1-(4-ethoxyphenyl)-N-(2-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

Catalog ID
STK595100
SMILES CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)cc3c1ccc(cc1)C

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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 C33H33N3O3 MW 519.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O3/c1-4-39-25-18-16-24(17-19-25)30-26-9-7-8-20-35-28(23-14-12-22(2)13-15-23)21-36(33(26)35)31(30)32(37)34-27-10-5-6-11-29(27)38-3/h5-6,10-19,21H,4,7-9,20H2,1-3H3,(H,34,37)
InChIKey
KVHLZVCHKMBPKH-UHFFFAOYSA-N
Synonyms
896169-03-2
1(4ethoxyphenyl)N(2methoxyphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4ethoxyphenyl)N(2methoxyphenyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896169032
CCOC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)C)C(=O)NC6=CC=CC=C6OC
InChI=1SC33H33N3O3c143925181624(171925)3026978203528(23141222(2)131523)2136(33(26)35)31(30)32(37)342710561129(27)383h56101921H47920H213H3(H3437)
MFCD06613367
ZINC000002363042
ZINC02363042
ZINC2363042

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Available files

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