Vitas-M small molecule compound

3-butyl-5-(4-methoxyphenyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-methoxybenzoate

Catalog ID
STK991110
SMILES CCCCn1cc(c2c1nc(c1ccc(cc1)OC)n1c2nc2c1cccc2)OC(=O)c1ccc(cc1)OC

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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 C31H28N4O4 MW 520.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O4/c1-4-5-18-34-19-26(39-31(36)21-12-16-23(38-3)17-13-21)27-29(34)33-28(20-10-14-22(37-2)15-11-20)35-25-9-7-6-8-24(25)32-30(27)35/h6-17,19H,4-5,18H2,1-3H3
InChIKey
LIBSQHZVOBDIHQ-UHFFFAOYSA-N
Synonyms
861119-82-6
3butyl5(4methoxyphenyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl4methoxybenzoate
3butyl5(4methoxyphenyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl4methoxybenzoate
861119826
CCCCN1C=C(C2=C1N=C(N3C2=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)OC(=O)C6=CC=C(C=C6)OC
InChI=1SC31H28N4O4c14518341926(3931(36)21121623(383)171321)2729(34)3328(20101422(372)151120)3525976824(25)3230(27)35h61719H4518H213H3
MFCD05683244
ZINC000009308917
ZINC09308917
ZINC9308917

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Available files

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