Vitas-M small molecule compound
N-(3-chlorophenyl)-4-phenyl-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL052448
SMILES Clc1cccc(c1)NC(=O)c1c(c2ccc(cc2)C(C)C)c2c3n1cc(n3CCCC2)c1ccccc1
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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 C32H30ClN3O MW 508.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O/c1-21(2)22-14-16-24(17-15-22)29-27-13-6-7-18-35-28(23-9-4-3-5-10-23)20-36(32(27)35)30(29)31(37)34-26-12-8-11-25(33)19-26/h3-5,8-12,14-17,19-21H,6-7,13,18H2,1-2H3,(H,34,37)InChIKey
DXQVMCCNBKGPAO-UHFFFAOYSA-NSynonyms
896168-61-9896168619
CC(C)C1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=CC=C5)C(=O)NC6=CC(=CC=C6)Cl
InChI=1SC32H30ClN3Oc121(2)22141624(171522)29271367183528(2394351023)2036(32(27)35)30(29)31(37)34261281125(33)1926h3581214171921H671318H212H3(H3437)
MFCD06598211
N(3chlorophenyl)1(4isopropylphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
N(3chlorophenyl)4phenyl1(4(propan2yl)phenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
ZINC000002213581
ZINC02213581
ZINC2213581
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