Vitas-M small molecule compound
4-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK782130
SMILES COc1ccccc1NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)Cl
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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 C32H30ClN3O2 MW 524.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O2/c1-20-11-12-23(18-21(20)2)29-25-8-6-7-17-35-27(22-13-15-24(33)16-14-22)19-36(32(25)35)30(29)31(37)34-26-9-4-5-10-28(26)38-3/h4-5,9-16,18-19H,6-8,17H2,1-3H3,(H,34,37)InChIKey
VNTZRMXAGBKGEB-UHFFFAOYSA-NSynonyms
4(4chlorophenyl)1(34dimethylphenyl)N(2methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
CC1=C(C=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC=CC=C6OC)C
InChI=1SC32H30ClN3O2c120111223(1821(20)2)2925867173527(22131524(33)161422)1936(32(25)35)30(29)31(37)34269451028(26)383h459161819H6817H213H3(H3437)
MFCD06016685
ZINC000012462269
ZINC12462269
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