Vitas-M small molecule compound
5-{[4-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-2-methoxyphenoxy]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK512616
SMILES COc1cc(CNCCc2c[nH]c3c2cccc3)ccc1OCc1ccc2c(c1)n(C)c(=O)n2C
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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 C28H30N4O3 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O3/c1-31-24-10-8-20(14-25(24)32(2)28(31)33)18-35-26-11-9-19(15-27(26)34-3)16-29-13-12-21-17-30-23-7-5-4-6-22(21)23/h4-11,14-15,17,29-30H,12-13,16,18H2,1-3H3InChIKey
PSDJYXDHFDPNPN-UHFFFAOYSA-NSynonyms
5((4(((2(1Hindol3yl)ethyl)amino)methyl)2methoxyphenoxy)methyl)13dimethyl13dihydro2Hbenzimidazol2one
5((4((2(1Hindol3yl)ethylamino)methyl)2methoxyphenoxy)methyl)13dimethylbenzimidazol2one
CN1C2=C(C=C(C=C2)COC3=C(C=C(C=C3)CNCCC4=CNC5=CC=CC=C54)OC)N(C1=O)C
COc1cc(CNCCc2c(nH)c3c2cccc3)ccc1OCc1ccc2c(c1)n(C)c(=O)n2C
InChI=1SC28H30N4O3c1312410820(1425(24)32(2)28(31)33)18352611919(1527(26)343)1629131221173023754622(21)23h4111415172930H12131618H213H3
MFCD13370206
ZINC000032616898
ZINC32616898
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