Vitas-M small molecule compound
1-(4-chlorophenyl)-N-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK591996
SMILES COc1ccc(cc1)NC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(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 C31H28ClN3O2 MW 510.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O2/c1-20-6-8-21(9-7-20)27-19-35-29(30(36)33-24-14-16-25(37-2)17-15-24)28(22-10-12-23(32)13-11-22)26-5-3-4-18-34(27)31(26)35/h6-17,19H,3-5,18H2,1-2H3,(H,33,36)InChIKey
OLGOMXPZJODWKK-UHFFFAOYSA-NSynonyms
896167-02-51(4chlorophenyl)N(4methoxyphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4chlorophenyl)N(4methoxyphenyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896167025
CC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC=C(C=C6)OC
InChI=1SC31H28ClN3O2c1206821(9720)27193529(30(36)3324141625(372)171524)28(22101223(32)131122)265341834(27)31(26)35h61719H3518H212H3(H3336)
MFCD06604862
ZINC000002242174
ZINC02242174
ZINC2242174
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