Vitas-M small molecule compound

4-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)-N-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

Catalog ID
STK591801
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(c(c1)Cl)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 C31H27Cl2N3O2 MW 544.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27Cl2N3O2/c1-19-6-11-22(12-7-19)34-30(37)29-28(20-8-13-23(38-2)14-9-20)24-5-3-4-16-35-27(18-36(29)31(24)35)21-10-15-25(32)26(33)17-21/h6-15,17-18H,3-5,16H2,1-2H3,(H,34,37)
InChIKey
STYXTOAGPPEYKA-UHFFFAOYSA-N
Synonyms
896169-06-5
4(34dichlorophenyl)1(4methoxyphenyl)N(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
4(34dichlorophenyl)1(4methoxyphenyl)N(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896169065
CC1=CC=C(C=C1)NC(=O)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC(=C(C=C5)Cl)Cl)C6=CC=C(C=C6)OC
InChI=1SC31H27Cl2N3O2c11961122(12719)3430(37)2928(2081323(382)14920)24534163527(1836(29)31(24)35)21101525(32)26(33)1721h6151718H3516H212H3(H3437)
MFCD06608002
ZINC000002338453
ZINC2338453

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Available files

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